N,N'-bis[(4-methylphenyl)sulfonylmethyl]pentanedithioamide

Systemtic Name: N,N'-bis[(4-methylphenyl)sulfonylmethyl]pentanedithioamide Openeye Name: N,N'-bis(p-tolylsulfonylmethyl)pentanedithioamide CAS Name: N,N'-bis[(4-methylphenyl)sulfonylmethyl]pentanedithioamide IUPAC Name: N,N'-bis[(4-methylphenyl)sulfonylmethyl]pentanedithioamide Traditional Name: N,N'-bis(tosylmethyl)pentanedithioamide Formula: C21H26N2O4S4 MolecularWeight: 498.70214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=S)CCCC(=S)NCS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=S)CCCC(=S)NCS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H26N2O4S4/c1-16-6-10-18(11-7-16)30(24,25)14-22-20(28)4-3-5-21(29)23-15-31(26,27)19-12-8-17(2)9-13-19/h6-13H,3-5,14-15H2,1-2H3,(H,22,28)(H,23,29)