5-(3-azanyl-4-cyano-1H-pyrazol-5-yl)pentyl-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 5-(3-azanyl-4-cyano-1H-pyrazol-5-yl)pentyl-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 5-(3-amino-4-cyano-1H-pyrazol-5-yl)pentyl-[2-(3,4-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: 5-(3-amino-4-cyano-1H-pyrazol-5-yl)pentyl-[2-(3,4-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: 5-(3-amino-4-cyano-1H-pyrazol-5-yl)pentyl-[2-(3,4-dimethylanilino)-2-oxoethyl]azanium Traditional Name: 5-(3-amino-4-cyano-1H-pyrazol-5-yl)pentyl-[2-(3,4-dimethylanilino)-2-keto-ethyl]ammonium Formula: C19H27N6O+ MolecularWeight: 355.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH2+]CCCCCC2=C(C(=NN2)N)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH2+]CCCCCC2=C(C(=NN2)N)C#N)C

InChI

InChI=1S/C19H26N6O/c1-13-7-8-15(10-14(13)2)23-18(26)12-22-9-5-3-4-6-17-16(11-20)19(21)25-24-17/h7-8,10,22H,3-6,9,12H2,1-2H3,(H,23,26)(H3,21,24,25)/p+1