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

Systemtic Name: 5-azanyl-1-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[2-(4-ethoxyanilino)-2-oxo-ethyl]-N-phenethyl-triazole-4-carboxamide CAS Name: 5-amino-1-[2-(4-ethoxyanilino)-2-oxoethyl]-N-phenethyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-[2-(4-ethoxyanilino)-2-oxoethyl]-N-phenethyltriazole-4-carboxamide Traditional Name: 5-amino-1-[2-keto-2-(p-phenetidino)ethyl]-N-phenethyl-triazole-4-carboxamide Formula: C21H24N6O3 MolecularWeight: 408.45366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

InChI

InChI=1S/C21H24N6O3/c1-2-30-17-10-8-16(9-11-17)24-18(28)14-27-20(22)19(25-26-27)21(29)23-13-12-15-6-4-3-5-7-15/h3-11H,2,12-14,22H2,1H3,(H,23,29)(H,24,28)