methyl (1E)-N-[methyl(2-pyridin-2-ylethoxysulfinyl)carbamoyl]oxyethanimidothioate

Systemtic Name: methyl (1E)-N-[methyl(2-pyridin-2-ylethoxysulfinyl)carbamoyl]oxyethanimidothioate Openeye Name: methyl (1E)-N-[methyl-[2-(2-pyridyl)ethoxysulfinyl]carbamoyl]oxyethanimidothioate CAS Name: (1E)-N-[[methyl-[2-(2-pyridinyl)ethoxysulfinyl]amino]-oxomethoxy]ethanimidothioic acid methyl ester IUPAC Name: methyl (1E)-N-[methyl(2-pyridin-2-ylethoxysulfinyl)carbamoyl]oxyethanimidothioate Traditional Name: (1E)-N-[methyl-[2-(2-pyridyl)ethoxysulfinyl]carbamoyl]oxythioacetimidic acid methyl ester Formula: C12H17N3O4S2 MolecularWeight: 331.41108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)N(C)S(=O)OCCC1=CC=CC=N1)SC

Isomeric SMILES

C/C(=N\OC(=O)N(C)S(=O)OCCC1=CC=CC=N1)/SC

InChI

InChI=1S/C12H17N3O4S2/c1-10(20-3)14-19-12(16)15(2)21(17)18-9-7-11-6-4-5-8-13-11/h4-6,8H,7,9H2,1-3H3/b14-10+