ethyl 2-[(1,5-diphenyl-1,2,3-triazol-4-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(1,5-diphenyl-1,2,3-triazol-4-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1,5-diphenyltriazole-4-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(1,5-diphenyl-4-triazolyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1,5-diphenyltriazole-4-carbonyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(1,5-diphenyltriazole-4-carbonyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H22N4O3S MolecularWeight: 494.56428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=C(N(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=C(N(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O3S/c1-2-35-28(34)23-22(19-12-6-3-7-13-19)18-36-27(23)29-26(33)24-25(20-14-8-4-9-15-20)32(31-30-24)21-16-10-5-11-17-21/h3-18H,2H2,1H3,(H,29,33)