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

Systemtic Name: methyl 2-[(4-chlorophenyl)carbamoyl]-4-methyl-5-(4-methylphenyl)-3H-pyrazole-4-carboxylate Openeye Name: methyl 2-[(4-chlorophenyl)carbamoyl]-4-methyl-5-(p-tolyl)-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-chloroanilino)-oxomethyl]-4-methyl-5-(4-methylphenyl)-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chlorophenyl)carbamoyl]-4-methyl-5-(4-methylphenyl)-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-chlorophenyl)carbamoyl]-4-methyl-3-(p-tolyl)-2-pyrazoline-4-carboxylic acid methyl ester Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O3/c1-13-4-6-14(7-5-13)17-20(2,18(25)27-3)12-24(23-17)19(26)22-16-10-8-15(21)9-11-16/h4-11H,12H2,1-3H3,(H,22,26)