5-azanyl-N-(4-ethylphenyl)-1-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-N-(4-ethylphenyl)-1-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(4-ethylphenyl)-1-[2-(3-methylanilino)-2-oxo-ethyl]triazole-4-carboxamide CAS Name: 5-amino-N-(4-ethylphenyl)-1-[2-(3-methylanilino)-2-oxoethyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(4-ethylphenyl)-1-[2-(3-methylanilino)-2-oxoethyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(4-ethylphenyl)-1-[2-keto-2-(m-toluidino)ethyl]triazole-4-carboxamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC=CC(=C3)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC=CC(=C3)C)N

InChI

InChI=1S/C20H22N6O2/c1-3-14-7-9-15(10-8-14)23-20(28)18-19(21)26(25-24-18)12-17(27)22-16-6-4-5-13(2)11-16/h4-11H,3,12,21H2,1-2H3,(H,22,27)(H,23,28)