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

Systemtic Name: ethyl 4,5-dimethyl-2-[(5-methyl-1-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(5-methyl-1-phenyl-triazole-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(5-methyl-1-phenyl-4-triazolyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(5-methyl-1-phenyltriazole-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(5-methyl-1-phenyl-triazole-4-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H20N4O3S/c1-5-26-19(25)15-11(2)13(4)27-18(15)20-17(24)16-12(3)23(22-21-16)14-9-7-6-8-10-14/h6-10H,5H2,1-4H3,(H,20,24)