[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] N-hexadecylcarbamodithioate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] N-hexadecylcarbamodithioate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] N-hexadecylcarbamodithioate CAS Name: N-hexadecylcarbamodithioic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] N-hexadecylcarbamodithioate Traditional Name: N-cetylcarbamodithioic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C25H44N4OS2 MolecularWeight: 480.77306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H44N4OS2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-28-25(31)32-23-24(30)29(21-16-18-26)22-17-19-27/h2-17,20-23H2,1H3,(H,28,31)