O-octyl [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-octyl [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-octyl [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]thio]methanethioic acid O-octyl ester IUPAC Name: O-octyl [2-[bis(2-cyanoethyl)amino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[bis(2-cyanoethyl)amino]-2-keto-ethyl]thio]methanethioic acid O-octyl ester Formula: C17H27N3O2S2 MolecularWeight: 369.54518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=S)SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CCCCCCCCOC(=S)SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C17H27N3O2S2/c1-2-3-4-5-6-7-14-22-17(23)24-15-16(21)20(12-8-10-18)13-9-11-19/h2-9,12-15H2,1H3