2,2-dimethyl-6-[2-(4-methylphenyl)sulfonylethylsulfanyl]-3H-thiopyran-4-one

Systemtic Name: 2,2-dimethyl-6-[2-(4-methylphenyl)sulfonylethylsulfanyl]-3H-thiopyran-4-one Openeye Name: 2,2-dimethyl-6-[2-(p-tolylsulfonyl)ethylsulfanyl]-3H-thiopyran-4-one CAS Name: 2,2-dimethyl-6-[2-(4-methylphenyl)sulfonylethylthio]-3H-thiopyran-4-one IUPAC Name: 2,2-dimethyl-6-[2-(4-methylphenyl)sulfonylethylsulfanyl]-3H-thiopyran-4-one Traditional Name: 2,2-dimethyl-6-(2-tosylethylthio)-3H-thiopyran-4-one Formula: C16H20O3S3 MolecularWeight: 356.5232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=CC(=O)CC(S2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=CC(=O)CC(S2)(C)C

InChI

InChI=1S/C16H20O3S3/c1-12-4-6-14(7-5-12)22(18,19)9-8-20-15-10-13(17)11-16(2,3)21-15/h4-7,10H,8-9,11H2,1-3H3