2-cyanoethyl (1Z)-N-[[[(Z)-1-(2-cyanoethylsulfanyl)ethylideneamino]oxycarbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate

Systemtic Name: 2-cyanoethyl (1Z)-N-[[[(Z)-1-(2-cyanoethylsulfanyl)ethylideneamino]oxycarbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate Openeye Name: 2-cyanoethyl (1Z)-N-[[[(Z)-1-(2-cyanoethylsulfanyl)ethylideneamino]oxycarbonyl-methyl-amino]sulfanyl-methyl-carbamoyl]oxyethanimidothioate CAS Name: (1Z)-N-[[[[[[(Z)-1-(2-cyanoethylthio)ethylideneamino]oxy-oxomethyl]-methylamino]thio]-methylamino]-oxomethoxy]ethanimidothioic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (1Z)-N-[[[(Z)-1-(2-cyanoethylsulfanyl)ethylideneamino]oxycarbonyl-methylamino]sulfanyl-methylcarbamoyl]oxyethanimidothioate Traditional Name: (1Z)-N-[[[[(Z)-1-(2-cyanoethylthio)ethylideneamino]oxycarbonyl-methyl-amino]thio]-methyl-carbamoyl]oxythioacetimidic acid 2-cyanoethyl ester Formula: C14H20N6O4S3 MolecularWeight: 432.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SCCC#N)SCCC#N

Isomeric SMILES

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

InChI

InChI=1S/C14H20N6O4S3/c1-11(25-9-5-7-15)17-23-13(21)19(3)27-20(4)14(22)24-18-12(2)26-10-6-8-16/h5-6,9-10H2,1-4H3/b17-11-,18-12-