O2-methyl O4-propyl 5-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-propyl 5-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-methyl O4-propyl 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 O2-methyl ester O4-propyl ester IUPAC Name: 2-O-methyl 4-O-propyl 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 O2-methyl ester O4-propyl ester Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O5S/c1-4-15-35-26(32)21-17(2)23(27(33)34-3)36-25(21)28-24(31)20-16-30(19-13-9-6-10-14-19)29-22(20)18-11-7-5-8-12-18/h5-14,16H,4,15H2,1-3H3,(H,28,31)