(2-azanyl-2-oxidanylidene-ethyl) (1Z)-N-[(4-bromophenyl)sulfanyl-methyl-carbamoyl]oxyethanimidothioate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (1Z)-N-[(4-bromophenyl)sulfanyl-methyl-carbamoyl]oxyethanimidothioate Openeye Name: (2-amino-2-oxo-ethyl) (1Z)-N-[(4-bromophenyl)sulfanyl-methyl-carbamoyl]oxyethanimidothioate CAS Name: (1Z)-N-[[[(4-bromophenyl)thio]-methylamino]-oxomethoxy]ethanimidothioic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (1Z)-N-[(4-bromophenyl)sulfanyl-methylcarbamoyl]oxyethanimidothioate Traditional Name: (1Z)-N-[[(4-bromophenyl)thio]-methyl-carbamoyl]oxythioacetimidic acid (2-amino-2-keto-ethyl) ester Formula: C12H14BrN3O3S2 MolecularWeight: 392.29186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrN3O3S2/c1-8(20-7-11(14)17)15-19-12(18)16(2)21-10-5-3-9(13)4-6-10/h3-6H,7H2,1-2H3,(H2,14,17)/b15-8-