2-cyanoethyl (1Z)-3,3-dimethyl-2-(methylcarbamoyl)-N-oxidanyl-butanimidothioate

Systemtic Name: 2-cyanoethyl (1Z)-3,3-dimethyl-2-(methylcarbamoyl)-N-oxidanyl-butanimidothioate Openeye Name: 2-cyanoethyl (1Z)-N-hydroxy-3,3-dimethyl-2-(methylcarbamoyl)butanimidothioate CAS Name: (1Z)-N-hydroxy-3,3-dimethyl-2-(methylcarbamoyl)butanimidothioic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (1Z)-N-hydroxy-3,3-dimethyl-2-(methylcarbamoyl)butanimidothioate Traditional Name: (1Z)-N-hydroxy-3,3-dimethyl-2-(methylcarbamoyl)thiobutyrimidic acid 2-cyanoethyl ester Formula: C11H19N3O2S MolecularWeight: 257.35246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NC)C(=NO)SCCC#N

Isomeric SMILES

CC(C)(C)C(C(=O)NC)/C(=N/O)/SCCC#N

InChI

InChI=1S/C11H19N3O2S/c1-11(2,3)8(9(15)13-4)10(14-16)17-7-5-6-12/h8,16H,5,7H2,1-4H3,(H,13,15)/b14-10-