2-[(E)-2-methyl-5-(phenylsulfonyl)pent-4-en-2-yl]-1,3-dithiane

Systemtic Name: 2-[(E)-2-methyl-5-(phenylsulfonyl)pent-4-en-2-yl]-1,3-dithiane Openeye Name: 2-[(E)-4-(benzenesulfonyl)-1,1-dimethyl-but-3-enyl]-1,3-dithiane CAS Name: 2-[(E)-5-(benzenesulfonyl)-2-methylpent-4-en-2-yl]-1,3-dithiane IUPAC Name: 2-[(E)-5-(benzenesulfonyl)-2-methylpent-4-en-2-yl]-1,3-dithiane Traditional Name: 2-[(E)-4-besyl-1,1-dimethyl-but-3-enyl]-1,3-dithiane Formula: C16H22O2S3 MolecularWeight: 342.53968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC=CS(=O)(=O)C1=CC=CC=C1)C2SCCCS2

Isomeric SMILES

CC(C)(C/C=C/S(=O)(=O)C1=CC=CC=C1)C2SCCCS2

InChI

InChI=1S/C16H22O2S3/c1-16(2,15-19-11-7-12-20-15)10-6-13-21(17,18)14-8-4-3-5-9-14/h3-6,8-9,13,15H,7,10-12H2,1-2H3/b13-6+