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3-[1-(5-nitropyridin-2-yl)-1,2,3-triazol-4-yl]benzenecarbonitrile

Systemtic Name:	3-[1-(5-nitropyridin-2-yl)-1,2,3-triazol-4-yl]benzenecarbonitrile
Openeye Name:	3-[1-(5-nitro-2-pyridyl)triazol-4-yl]benzonitrile
CAS Name:	3-[1-(5-nitro-2-pyridinyl)-4-triazolyl]benzonitrile
IUPAC Name:	3-[1-(5-nitropyridin-2-yl)triazol-4-yl]benzonitrile
Traditional Name:	3-[1-(5-nitro-2-pyridyl)triazol-4-yl]benzonitrile
Formula:	C₁₄H₈N₆O₂
MolecularWeight:	292.25232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CN(N=N2)C3=NC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=CN(N=N2)C3=NC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H8N6O2/c15-7-10-2-1-3-11(6-10)13-9-19(18-17-13)14-5-4-12(8-16-14)20(21)22/h1-6,8-9H

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5-[[1-[2-[4-[3,5-dimethyl-4-[[3-[[1-methyl-3-[3-(2,3,4,5-tetrahydropyridin-6-ylamino)propyl]indazol-6-yl]carbonylamino]-1-oxidanyl-1-oxidanylidene-propan-2-yl]sulfamoyl]phenoxy]butanoylamino]ethylamino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-5-oxidanylidene-4-[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]ethanoylamino]pentanoic acid
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-oxidanyl-propanoyl]amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]ethanoylamino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]-5-oxidanylidene-pentanoyl]amino]-3-methyl-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-4-methyl-pentanoic acid
(2S)-N-[(2R)-1-azanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl]-1-[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2R)-5-[bis(azanyl)methylideneamino]-2-ethanoyl-pentanoyl]amino]-3-sulfanyl-propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]pentanoyl]amino]-3-methyl-butanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]pyrrolidine-2-carboxamide
5-[5-[2-[2-[3-(2-azanyloxyethanoylamino)propoxy]ethoxy]ethoxy]pentanoylamino]-N1-[3-[2-[2-[3-[6-[(5-methyl-2-oxidanylidene-imidazolidin-4-yl)methylsulfanyl]hexanoylamino]propoxy]ethoxy]ethoxy]propyl]-N3-[3-[2-[2-[2-[5-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]ethoxy]ethoxy]ethoxy]propyl]benzene-1,3-dicarboxamide
(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-2-(2-azanylethanoylamino)-5-oxidanylidene-pentanoyl]amino]propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]-5-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]ami
(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-6-azanyl-2-[2-[2-[[(2S)-2-[[(2S,3S)-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]ethanoylamino]-3-methyl-pentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]ethanoylamino]ethanoylamino]hexanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-3-sulfanyl-propanoyl]amino]-4-methyl-pentanoic acid
(2S)-2-[[(2S)-2-[[(2S)-6-azanyl-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-azanyl-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
(3S)-3-[[(2S)-6-azanyl-2-[[(2S,3R)-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-5-oxidanylidene-2-[[(2S)-3-oxidanyl-2-[[(2S)-2-[[(2S)-3-oxidanyl-2-[[(2S)-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]pentanoyl]amino]-3-methyl-butanoyl]amino]propanoyl]amino]ethanoylamino]-3-oxidanyl-butanoyl]amino]hexanoyl]amino]-4-[[(2S)-1-[[(2S)-3-(1H-imidazol-5-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanyli
(4S)-5-[[(2S,3R)-1-[[2-[[(2S)-5-azanyl-1-[[(2S)-5-azanyl-1-[[(2S,3R)-1-[[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-4-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-m
(2S)-1-[(2S,3S)-2-[2-[[(2S)-6-azanyl-2-[[(2S)-5-azanyl-2-[[(2S)-4-azanyl-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-(2-azanylethanoylamino)-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butanoyl]amino]propanoyl]amino]-4-methyl-pentanoyl]amino]-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]hexanoyl]amino]ethanoylamino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid