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

Systemtic Name: O-dodecyl [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-dodecyl [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]thio]methanethioic acid O-dodecyl ester IUPAC Name: O-dodecyl [2-[bis(2-cyanoethyl)amino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[bis(2-cyanoethyl)amino]-2-keto-ethyl]thio]methanethioic acid O-lauryl ester Formula: C21H35N3O2S2 MolecularWeight: 425.6515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-18-26-21(27)28-19-20(25)24(16-12-14-22)17-13-15-23/h2-13,16-19H2,1H3