methyl 5-(4-methylthiophen-2-yl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-(4-methylthiophen-2-yl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 5-(4-methyl-2-thienyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(4-methyl-2-thiophenyl)-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-methylthiophen-2-yl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-(4-methyl-2-thienyl)-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CSC(=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C16H14N2O2S/c1-11-8-15(21-10-11)14-9-13(16(19)20-2)17-18(14)12-6-4-3-5-7-12/h3-10H,1-2H3