phenyl (1Z)-2-(methylcarbamoyl)-N-oxidanyl-butanimidothioate

Systemtic Name: phenyl (1Z)-2-(methylcarbamoyl)-N-oxidanyl-butanimidothioate Openeye Name: phenyl (1Z)-N-hydroxy-2-(methylcarbamoyl)butanimidothioate CAS Name: (1Z)-N-hydroxy-2-(methylcarbamoyl)butanimidothioic acid phenyl ester IUPAC Name: phenyl (1Z)-N-hydroxy-2-(methylcarbamoyl)butanimidothioate Traditional Name: (1Z)-N-hydroxy-2-(methylcarbamoyl)thiobutyrimidic acid phenyl ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC)C(=NO)SC1=CC=CC=C1

Isomeric SMILES

CCC(C(=O)NC)/C(=N/O)/SC1=CC=CC=C1

InChI

InChI=1S/C12H16N2O2S/c1-3-10(11(15)13-2)12(14-16)17-9-7-5-4-6-8-9/h4-8,10,16H,3H2,1-2H3,(H,13,15)/b14-12-