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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NCC3=CC=CC=C3)N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NCC3=CC=CC=C3)N

InChI

InChI=1S/C20H22N6O2/c1-2-15-10-6-7-11-16(15)23-17(27)13-26-19(21)18(24-25-26)20(28)22-12-14-8-4-3-5-9-14/h3-11H,2,12-13,21H2,1H3,(H,22,28)(H,23,27)