methyl (E)-3-[bis(methylsulfanyl)methylideneamino]-3-(3-methylphenyl)-2-methylsulfonyl-prop-2-enedithioate

Systemtic Name: methyl (E)-3-[bis(methylsulfanyl)methylideneamino]-3-(3-methylphenyl)-2-methylsulfonyl-prop-2-enedithioate Openeye Name: methyl (E)-3-[bis(methylsulfanyl)methyleneamino]-2-methylsulfonyl-3-(m-tolyl)prop-2-enedithioate CAS Name: (E)-3-[bis(methylthio)methylideneamino]-3-(3-methylphenyl)-2-methylsulfonyl-2-propenedithioic acid methyl ester IUPAC Name: methyl (E)-3-[bis(methylsulfanyl)methylideneamino]-3-(3-methylphenyl)-2-methylsulfonylprop-2-enedithioate Traditional Name: (E)-3-[bis(methylthio)methyleneamino]-2-mesyl-3-(m-tolyl)prop-2-enedithioic acid methyl ester Formula: C15H19NO2S5 MolecularWeight: 405.64186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=C(C(=S)SC)S(=O)(=O)C)N=C(SC)SC

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C(/C(=S)SC)\S(=O)(=O)C)/N=C(SC)SC

InChI

InChI=1S/C15H19NO2S5/c1-10-7-6-8-11(9-10)12(16-15(21-3)22-4)13(14(19)20-2)23(5,17)18/h6-9H,1-5H3/b13-12+