3,3-bis[(4-methylphenyl)sulfanyl]pentane-2,4-dione

Systemtic Name: 3,3-bis[(4-methylphenyl)sulfanyl]pentane-2,4-dione Openeye Name: 3,3-bis(p-tolylsulfanyl)pentane-2,4-dione CAS Name: 3,3-bis[(4-methylphenyl)thio]pentane-2,4-dione IUPAC Name: 3,3-bis[(4-methylphenyl)sulfanyl]pentane-2,4-dione Traditional Name: 3,3-bis(p-tolylthio)pentane-2,4-dione Formula: C19H20O2S2 MolecularWeight: 344.4909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C(=O)C)(C(=O)C)SC2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(C(=O)C)(C(=O)C)SC2=CC=C(C=C2)C

InChI

InChI=1S/C19H20O2S2/c1-13-5-9-17(10-6-13)22-19(15(3)20,16(4)21)23-18-11-7-14(2)8-12-18/h5-12H,1-4H3