ethyl 4-(2-chlorophenyl)-2-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-2-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-2-[[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-2-[[3-(4-methylphenyl)-1-phenylpyrazole-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C30H24ClN3O3S MolecularWeight: 542.04786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C30H24ClN3O3S/c1-3-37-30(36)26-24(22-11-7-8-12-25(22)31)18-38-29(26)32-28(35)23-17-34(21-9-5-4-6-10-21)33-27(23)20-15-13-19(2)14-16-20/h4-18H,3H2,1-2H3,(H,32,35)