2,2-dimethyl-6-[2-(phenylsulfonyl)ethylsulfanyl]-3H-thiopyran-4-one

Systemtic Name: 2,2-dimethyl-6-[2-(phenylsulfonyl)ethylsulfanyl]-3H-thiopyran-4-one Openeye Name: 6-[2-(benzenesulfonyl)ethylsulfanyl]-2,2-dimethyl-3H-thiopyran-4-one CAS Name: 6-[2-(benzenesulfonyl)ethylthio]-2,2-dimethyl-3H-thiopyran-4-one IUPAC Name: 6-[2-(benzenesulfonyl)ethylsulfanyl]-2,2-dimethyl-3H-thiopyran-4-one Traditional Name: 6-(2-besylethylthio)-2,2-dimethyl-3H-thiopyran-4-one Formula: C15H18O3S3 MolecularWeight: 342.49662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C=C(S1)SCCS(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C=C(S1)SCCS(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C15H18O3S3/c1-15(2)11-12(16)10-14(20-15)19-8-9-21(17,18)13-6-4-3-5-7-13/h3-7,10H,8-9,11H2,1-2H3