(2-azanyl-2-oxidanylidene-ethyl) (1Z)-N-[methyl(phenylsulfanyl)carbamoyl]oxyethanimidothioate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (1Z)-N-[methyl(phenylsulfanyl)carbamoyl]oxyethanimidothioate Openeye Name: (2-amino-2-oxo-ethyl) (1Z)-N-[methyl(phenylsulfanyl)carbamoyl]oxyethanimidothioate CAS Name: (1Z)-N-[[methyl-(phenylthio)amino]-oxomethoxy]ethanimidothioic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (1Z)-N-[methyl(phenylsulfanyl)carbamoyl]oxyethanimidothioate Traditional Name: (1Z)-N-[methyl-(phenylthio)carbamoyl]oxythioacetimidic acid (2-amino-2-keto-ethyl) ester Formula: C12H15N3O3S2 MolecularWeight: 313.3958

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)N(C)SC1=CC=CC=C1)SCC(=O)N

Isomeric SMILES

C/C(=N/OC(=O)N(C)SC1=CC=CC=C1)/SCC(=O)N

InChI

InChI=1S/C12H15N3O3S2/c1-9(19-8-11(13)16)14-18-12(17)15(2)20-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H2,13,16)/b14-9-