ethyl (4S,5R,6S)-6-ethyl-4-methyl-4-oxidanyl-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl (4S,5R,6S)-6-ethyl-4-methyl-4-oxidanyl-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl (4S,5R,6S)-6-ethyl-4-hydroxy-4-methyl-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R,6S)-6-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S,5R,6S)-6-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R,6S)-6-ethyl-4-hydroxy-4-methyl-2-thioxo-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C10H18N2O3S MolecularWeight: 246.32652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(NC(=S)N1)(C)O)C(=O)OCC

Isomeric SMILES

CC[C@H]1[C@H]([C@](NC(=S)N1)(C)O)C(=O)OCC

InChI

InChI=1S/C10H18N2O3S/c1-4-6-7(8(13)15-5-2)10(3,14)12-9(16)11-6/h6-7,14H,4-5H2,1-3H3,(H2,11,12,16)/t6-,7-,10-/m0/s1