1,1-bis(phenylsulfanyl)pentane-2,4-dione

Systemtic Name: 1,1-bis(phenylsulfanyl)pentane-2,4-dione Openeye Name: 1,1-bis(phenylsulfanyl)pentane-2,4-dione CAS Name: 1,1-bis(phenylthio)pentane-2,4-dione IUPAC Name: 1,1-bis(phenylsulfanyl)pentane-2,4-dione Traditional Name: 1,1-bis(phenylthio)pentane-2,4-dione Formula: C17H16O2S2 MolecularWeight: 316.43774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C(SC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(=O)C(SC1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C17H16O2S2/c1-13(18)12-16(19)17(20-14-8-4-2-5-9-14)21-15-10-6-3-7-11-15/h2-11,17H,12H2,1H3