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

Systemtic Name: (4-methoxyphenyl)methyl (4S,5S)-2-oxidanylidene-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4S,5S)-2-oxo-5-propyl-6-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: (4S,5S)-2-oxo-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4S,5S)-2-oxo-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: (4S,5S)-2-keto-5-propyl-6-thioxo-hexahydropyrimidine-4-carboxylic acid p-anisyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(NC(=O)NC1=S)C(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4S/c1-3-4-12-13(17-16(20)18-14(12)23)15(19)22-9-10-5-7-11(21-2)8-6-10/h5-8,12-13H,3-4,9H2,1-2H3,(H2,17,18,20,23)/t12-,13-/m0/s1