(4-methoxyphenyl)methyl (4S,5S)-5-methyl-2-oxidanylidene-6-sulfanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (4S,5S)-5-methyl-2-oxidanylidene-6-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4S,5S)-5-methyl-2-oxo-6-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: (4S,5S)-5-methyl-2-oxo-6-sulfanylidene-1,3-diazinane-4-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4S,5S)-5-methyl-2-oxo-6-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: (4S,5S)-2-keto-5-methyl-6-thioxo-hexahydropyrimidine-4-carboxylic acid p-anisyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(=O)NC1=S)C(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H]1[C@H](NC(=O)NC1=S)C(=O)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C14H16N2O4S/c1-8-11(15-14(18)16-12(8)21)13(17)20-7-9-3-5-10(19-2)6-4-9/h3-6,8,11H,7H2,1-2H3,(H2,15,16,18,21)/t8-,11-/m0/s1