N-[1,3-bis[(4-methylphenyl)sulfonylsulfanyl]propan-2-yl]-N-methyl-cyclohexanamine

Systemtic Name: N-[1,3-bis[(4-methylphenyl)sulfonylsulfanyl]propan-2-yl]-N-methyl-cyclohexanamine Openeye Name: N-methyl-N-[2-(p-tolylsulfonylsulfanyl)-1-(p-tolylsulfonylsulfanylmethyl)ethyl]cyclohexanamine CAS Name: N-[1,3-bis[(4-methylphenyl)sulfonylthio]propan-2-yl]-N-methylcyclohexanamine IUPAC Name: N-[1,3-bis[(4-methylphenyl)sulfonylsulfanyl]propan-2-yl]-N-methylcyclohexanamine Traditional Name: cyclohexyl-methyl-[2-(tosylthio)-1-[(tosylthio)methyl]ethyl]amine Formula: C24H33NO4S4 MolecularWeight: 527.78312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SCC(CSS(=O)(=O)C2=CC=C(C=C2)C)N(C)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SCC(CSS(=O)(=O)C2=CC=C(C=C2)C)N(C)C3CCCCC3

InChI

InChI=1S/C24H33NO4S4/c1-19-9-13-23(14-10-19)32(26,27)30-17-22(25(3)21-7-5-4-6-8-21)18-31-33(28,29)24-15-11-20(2)12-16-24/h9-16,21-22H,4-8,17-18H2,1-3H3