2-cyanoethyl (1Z)-N-[methyl-(octadecyldisulfanyl)carbamoyl]oxyethanimidothioate

Systemtic Name: 2-cyanoethyl (1Z)-N-[methyl-(octadecyldisulfanyl)carbamoyl]oxyethanimidothioate Openeye Name: 2-cyanoethyl (1Z)-N-[methyl-(octadecyldisulfanyl)carbamoyl]oxyethanimidothioate CAS Name: (1Z)-N-[[methyl-(octadecyldisulfanyl)amino]-oxomethoxy]ethanimidothioic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (1Z)-N-[methyl-(octadecyldisulfanyl)carbamoyl]oxyethanimidothioate Traditional Name: (1Z)-N-[methyl-(stearyldisulfanyl)carbamoyl]oxythioacetimidic acid 2-cyanoethyl ester Formula: C25H47N3O2S3 MolecularWeight: 517.85458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSSN(C)C(=O)ON=C(C)SCCC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSSN(C)C(=O)O/N=C(/C)\SCCC#N

InChI

InChI=1S/C25H47N3O2S3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-32-33-28(3)25(29)30-27-24(2)31-22-20-21-26/h4-20,22-23H2,1-3H3/b27-24-