tert-butyl (4S,6R)-6-(hydroxymethyl)-1,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: tert-butyl (4S,6R)-6-(hydroxymethyl)-1,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: tert-butyl (4S,6R)-6-(hydroxymethyl)-1,6-dimethyl-2-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: (4S,6R)-6-(hydroxymethyl)-1,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S,6R)-6-(hydroxymethyl)-1,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: (4S,6R)-1,6-dimethyl-6-methylol-2-thioxo-hexahydropyrimidine-4-carboxylic acid tert-butyl ester Formula: C12H22N2O3S MolecularWeight: 274.37968

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(NC(=S)N1C)C(=O)OC(C)(C)C)CO

Isomeric SMILES

C[C@@]1(C[C@H](NC(=S)N1C)C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C12H22N2O3S/c1-11(2,3)17-9(16)8-6-12(4,7-15)14(5)10(18)13-8/h8,15H,6-7H2,1-5H3,(H,13,18)/t8-,12+/m0/s1