[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxylic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)pyrazole-4-carboxylic acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H15ClN2O3S/c1-12-6-7-17(25-12)16(22)11-24-18(23)14-8-20-21(10-14)9-13-4-2-3-5-15(13)19/h2-8,10H,9,11H2,1H3