diethyl 5-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O5S/c1-4-34-26(32)21-17(3)23(27(33)35-5-2)36-25(21)28-24(31)20-16-30(19-14-10-7-11-15-19)29-22(20)18-12-8-6-9-13-18/h6-16H,4-5H2,1-3H3,(H,28,31)