2-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)-3-oxidanylidene-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)-3-oxidanylidene-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-2-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)-3-oxo-pyrazole-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[4-(methylthio)phenyl]-3-oxo-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-2-(4-chlorophenyl)-N-(4-methylsulfanylphenyl)-3-oxopyrazole-4-carboxamide Traditional Name: 1-benzyl-2-(4-chlorophenyl)-3-keto-N-[4-(methylthio)phenyl]-3-pyrazoline-4-carboxamide Formula: C24H20ClN3O2S MolecularWeight: 449.9525

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2=CN(N(C2=O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2=CN(N(C2=O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H20ClN3O2S/c1-31-21-13-9-19(10-14-21)26-23(29)22-16-27(15-17-5-3-2-4-6-17)28(24(22)30)20-11-7-18(25)8-12-20/h2-14,16H,15H2,1H3,(H,26,29)