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

Systemtic Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylsulfonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylsulfonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-4-methyl-2-[(3-methylsulfonylanilino)-oxomethyl]-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-4-methyl-2-[(3-methylsulfonylphenyl)carbamoyl]-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-[(3-mesylphenyl)carbamoyl]-4-methyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C20H20ClN3O5S/c1-20(18(25)29-2)12-24(23-17(20)13-7-9-14(21)10-8-13)19(26)22-15-5-4-6-16(11-15)30(3,27)28/h4-11H,12H2,1-3H3,(H,22,26)