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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=NN(CC2(C)C(=O)OC)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CSC(=C1)C2=NN(CC2(C)C(=O)OC)C(=O)NC3=CC=C(C=C3)Cl

InChI

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