4-(4-methylphenyl)sulfanyl-5-oxidanyl-1,2-diphenyl-pyrazol-3-one

Systemtic Name: 4-(4-methylphenyl)sulfanyl-5-oxidanyl-1,2-diphenyl-pyrazol-3-one Openeye Name: 5-hydroxy-1,2-diphenyl-4-(p-tolylsulfanyl)pyrazol-3-one CAS Name: 5-hydroxy-4-[(4-methylphenyl)thio]-1,2-diphenyl-3-pyrazolone IUPAC Name: 5-hydroxy-4-(4-methylphenyl)sulfanyl-1,2-diphenylpyrazol-3-one Traditional Name: 5-hydroxy-1,2-diphenyl-4-(p-tolylthio)-3-pyrazolin-3-one Formula: C22H18N2O2S MolecularWeight: 374.45552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C22H18N2O2S/c1-16-12-14-19(15-13-16)27-20-21(25)23(17-8-4-2-5-9-17)24(22(20)26)18-10-6-3-7-11-18/h2-15,25H,1H3