methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylthiophen-2-yl)carbamoyl]-3H-pyrazole-4-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylthiophen-2-yl)carbamoyl]-3H-pyrazole-4-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methyl-2-thienyl)carbamoyl]-3H-pyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-4-methyl-2-[[(3-methyl-2-thiophenyl)amino]-oxomethyl]-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylthiophen-2-yl)carbamoyl]-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-methyl-1-[(3-methyl-2-thienyl)carbamoyl]-2-pyrazoline-4-carboxylic acid methyl ester Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)(C)C(=O)OC

Isomeric SMILES

CC1=C(SC=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)(C)C(=O)OC

InChI

InChI=1S/C18H18ClN3O3S/c1-11-8-9-26-15(11)20-17(24)22-10-18(2,16(23)25-3)14(21-22)12-4-6-13(19)7-5-12/h4-9H,10H2,1-3H3,(H,20,24)