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

Systemtic Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-methylsulfanyl-carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-methylsulfanyl-carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-chloro-N-(methylthio)anilino)-oxomethyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-methylsulfanylcarbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)-(methylthio)carbamoyl]-4-methyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C20H19Cl2N3O3S MolecularWeight: 452.35416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19Cl2N3O3S/c1-20(18(26)28-2)12-24(23-17(20)13-4-6-14(21)7-5-13)19(27)25(29-3)16-10-8-15(22)9-11-16/h4-11H,12H2,1-3H3