1-(4-methylphenyl)-3,3-bis(phenylsulfanyl)prop-2-en-1-one

Systemtic Name: 1-(4-methylphenyl)-3,3-bis(phenylsulfanyl)prop-2-en-1-one Openeye Name: 3,3-bis(phenylsulfanyl)-1-(p-tolyl)prop-2-en-1-one CAS Name: 1-(4-methylphenyl)-3,3-bis(phenylthio)-2-propen-1-one IUPAC Name: 1-(4-methylphenyl)-3,3-bis(phenylsulfanyl)prop-2-en-1-one Traditional Name: 3,3-bis(phenylthio)-1-(p-tolyl)prop-2-en-1-one Formula: C22H18OS2 MolecularWeight: 362.50772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=C(SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H18OS2/c1-17-12-14-18(15-13-17)21(23)16-22(24-19-8-4-2-5-9-19)25-20-10-6-3-7-11-20/h2-16H,1H3