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

Systemtic Name: 5-azanyl-N-(2-ethylphenyl)-1-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[2-(2-ethylanilino)-2-oxo-ethyl]-N-(2-ethylphenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[2-(2-ethylanilino)-2-oxoethyl]-N-(2-ethylphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[2-(2-ethylanilino)-2-oxoethyl]-N-(2-ethylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-[2-(2-ethylanilino)-2-keto-ethyl]-N-(2-ethylphenyl)triazole-4-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=CC=C3CC)N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=CC=C3CC)N

InChI

InChI=1S/C21H24N6O2/c1-3-14-9-5-7-11-16(14)23-18(28)13-27-20(22)19(25-26-27)21(29)24-17-12-8-6-10-15(17)4-2/h5-12H,3-4,13,22H2,1-2H3,(H,23,28)(H,24,29)