ethyl (2R)-2-[(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinan-4-yl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2R)-2-[(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinan-4-yl]-3-oxidanylidene-butanoate Openeye Name: ethyl (2R)-2-[(4R,6R)-6-methyl-2-thioxo-hexahydropyrimidin-4-yl]-3-oxo-butanoate CAS Name: (2R)-2-[(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinan-4-yl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinan-4-yl]-3-oxobutanoate Traditional Name: (2R)-3-keto-2-[(4R,6R)-6-methyl-2-thioxo-hexahydropyrimidin-4-yl]butyric acid ethyl ester Formula: C11H18N2O3S MolecularWeight: 258.33722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CC(NC(=S)N1)C)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C11H18N2O3S/c1-4-16-10(15)9(7(3)14)8-5-6(2)12-11(17)13-8/h6,8-9H,4-5H2,1-3H3,(H2,12,13,17)/t6-,8-,9+/m1/s1