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

Systemtic Name: dimethyl 5-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H21N3O5S/c1-15-19(24(30)32-2)23(34-21(15)25(31)33-3)26-22(29)18-14-28(17-12-8-5-9-13-17)27-20(18)16-10-6-4-7-11-16/h4-14H,1-3H3,(H,26,29)