2-(4-methylphenyl)sulfonyl-6,7-dihydro-5H-1,4-dithiepine

Systemtic Name: 2-(4-methylphenyl)sulfonyl-6,7-dihydro-5H-1,4-dithiepine Openeye Name: 2-(p-tolylsulfonyl)-6,7-dihydro-5H-1,4-dithiepine CAS Name: 2-(4-methylphenyl)sulfonyl-6,7-dihydro-5H-1,4-dithiepin IUPAC Name: 2-(4-methylphenyl)sulfonyl-6,7-dihydro-5H-1,4-dithiepine Traditional Name: 2-tosyl-6,7-dihydro-5H-1,4-dithiepin Formula: C12H14O2S3 MolecularWeight: 286.43336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CSCCCS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CSCCCS2

InChI

InChI=1S/C12H14O2S3/c1-10-3-5-11(6-4-10)17(13,14)12-9-15-7-2-8-16-12/h3-6,9H,2,7-8H2,1H3