methyl (4S,6R)-6-(ethanoylsulfanylmethyl)-2-oxidanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: methyl (4S,6R)-6-(ethanoylsulfanylmethyl)-2-oxidanylidene-1,3-diazinane-4-carboxylate Openeye Name: methyl (4S,6R)-6-(acetylsulfanylmethyl)-2-oxo-hexahydropyrimidine-4-carboxylate CAS Name: (4S,6R)-6-[(acetylthio)methyl]-2-oxo-1,3-diazinane-4-carboxylic acid methyl ester IUPAC Name: methyl (4S,6R)-6-(acetylsulfanylmethyl)-2-oxo-1,3-diazinane-4-carboxylate Traditional Name: (4S,6R)-6-[(acetylthio)methyl]-2-keto-hexahydropyrimidine-4-carboxylic acid methyl ester Formula: C9H14N2O4S MolecularWeight: 246.28346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CC(NC(=O)N1)C(=O)OC

Isomeric SMILES

CC(=O)SC[C@H]1C[C@H](NC(=O)N1)C(=O)OC

InChI

InChI=1S/C9H14N2O4S/c1-5(12)16-4-6-3-7(8(13)15-2)11-9(14)10-6/h6-7H,3-4H2,1-2H3,(H2,10,11,14)/t6-,7+/m1/s1