2-cyanoethyl (1E)-N-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate

Systemtic Name: 2-cyanoethyl (1E)-N-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate Openeye Name: 2-cyanoethyl (1E)-N-[methyl(morpholinosulfanyl)carbamoyl]oxyethanimidothioate CAS Name: (1E)-N-[[methyl-(4-morpholinylthio)amino]-oxomethoxy]ethanimidothioic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (1E)-N-[methyl(morpholin-4-ylsulfanyl)carbamoyl]oxyethanimidothioate Traditional Name: (1E)-N-[methyl-(morpholinothio)carbamoyl]oxythioacetimidic acid 2-cyanoethyl ester Formula: C11H18N4O3S2 MolecularWeight: 318.41562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)N(C)SN1CCOCC1)SCCC#N

Isomeric SMILES

C/C(=N\OC(=O)N(C)SN1CCOCC1)/SCCC#N

InChI

InChI=1S/C11H18N4O3S2/c1-10(19-9-3-4-12)13-18-11(16)14(2)20-15-5-7-17-8-6-15/h3,5-9H2,1-2H3/b13-10+