(1-cyano-2-methyl-dodecan-2-yl)sulfanylmethanedithioic acid

Systemtic Name: (1-cyano-2-methyl-dodecan-2-yl)sulfanylmethanedithioic acid Openeye Name: [1-(cyanomethyl)-1-methyl-undecyl]sulfanylmethanedithioic acid CAS Name: [(1-cyano-2-methyldodecan-2-yl)thio]methanedithioic acid IUPAC Name: (1-cyano-2-methyldodecan-2-yl)sulfanylmethanedithioic acid Traditional Name: [[1-(cyanomethyl)-1-methyl-undecyl]thio]methanedithioic acid Formula: C15H27NS3 MolecularWeight: 317.57658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)(CC#N)SC(=S)S

Isomeric SMILES

CCCCCCCCCCC(C)(CC#N)SC(=S)S

InChI

InChI=1S/C15H27NS3/c1-3-4-5-6-7-8-9-10-11-15(2,12-13-16)19-14(17)18/h3-12H2,1-2H3,(H,17,18)