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

Systemtic Name: 5-azanyl-N-(4-ethylphenyl)-1-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(4-ethylphenyl)-1-[2-(2-methylanilino)-2-oxo-ethyl]triazole-4-carboxamide CAS Name: 5-amino-N-(4-ethylphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(4-ethylphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(4-ethylphenyl)-1-[2-keto-2-(o-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=C3C)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC=CC=C3C)N

InChI

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