1-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-azepane

Systemtic Name: 1-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-azepane Openeye Name: 4-phenylsulfanyl-1-(p-tolylsulfonyl)azepane CAS Name: 1-(4-methylphenyl)sulfonyl-4-(phenylthio)azepane IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-phenylsulfanylazepane Traditional Name: 4-(phenylthio)-1-tosyl-azepane Formula: C19H23NO2S2 MolecularWeight: 361.52142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)SC3=CC=CC=C3

InChI

InChI=1S/C19H23NO2S2/c1-16-9-11-19(12-10-16)24(21,22)20-14-5-8-18(13-15-20)23-17-6-3-2-4-7-17/h2-4,6-7,9-12,18H,5,8,13-15H2,1H3