(4E)-1-(4-methylphenyl)sulfonyl-3-(phenylsulfanylmethyl)-4-(phenylsulfanylmethylidene)piperidine

Systemtic Name: (4E)-1-(4-methylphenyl)sulfonyl-3-(phenylsulfanylmethyl)-4-(phenylsulfanylmethylidene)piperidine Openeye Name: (4E)-3-(phenylsulfanylmethyl)-4-(phenylsulfanylmethylene)-1-(p-tolylsulfonyl)piperidine CAS Name: (4E)-1-(4-methylphenyl)sulfonyl-3-[(phenylthio)methyl]-4-[(phenylthio)methylidene]piperidine IUPAC Name: (4E)-1-(4-methylphenyl)sulfonyl-3-(phenylsulfanylmethyl)-4-(phenylsulfanylmethylidene)piperidine Traditional Name: (4E)-3-[(phenylthio)methyl]-4-[(phenylthio)methylene]-1-tosyl-piperidine Formula: C26H27NO2S3 MolecularWeight: 481.69308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=CSC3=CC=CC=C3)C(C2)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC/C(=C\SC3=CC=CC=C3)/C(C2)CSC4=CC=CC=C4

InChI

InChI=1S/C26H27NO2S3/c1-21-12-14-26(15-13-21)32(28,29)27-17-16-22(19-30-24-8-4-2-5-9-24)23(18-27)20-31-25-10-6-3-7-11-25/h2-15,19,23H,16-18,20H2,1H3/b22-19+