N'-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-nitro-benzohydrazide Openeye Name: N'-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-nitro-benzohydrazide CAS Name: N'-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide Traditional Name: N'-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]acetyl]-4-nitro-benzohydrazide Formula: C17H21N7O4S MolecularWeight: 419.45814

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N7O4S/c18-23-15(11-4-2-1-3-5-11)20-22-17(23)29-10-14(25)19-21-16(26)12-6-8-13(9-7-12)24(27)28/h6-9,11H,1-5,10,18H2,(H,19,25)(H,21,26)