(4E)-4-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[4-(4-chlorophenyl)sulfanylphenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[4-[(4-chlorophenyl)thio]phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[4-[(4-chlorophenyl)thio]benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C23H17ClN2OS MolecularWeight: 404.91188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H17ClN2OS/c1-16-22(23(27)26(25-16)19-5-3-2-4-6-19)15-17-7-11-20(12-8-17)28-21-13-9-18(24)10-14-21/h2-15H,1H3/b22-15+