methyl 1-phenyl-4-thiophen-2-ylcarbonyl-pyrazole-3-carboxylate

Systemtic Name: methyl 1-phenyl-4-thiophen-2-ylcarbonyl-pyrazole-3-carboxylate Openeye Name: methyl 1-phenyl-4-(thiophene-2-carbonyl)pyrazole-3-carboxylate CAS Name: 4-[oxo(thiophen-2-yl)methyl]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-phenyl-4-(thiophene-2-carbonyl)pyrazole-3-carboxylate Traditional Name: 1-phenyl-4-(2-thenoyl)pyrazole-3-carboxylic acid methyl ester Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1C(=O)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=NN(C=C1C(=O)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C16H12N2O3S/c1-21-16(20)14-12(15(19)13-8-5-9-22-13)10-18(17-14)11-6-3-2-4-7-11/h2-10H,1H3