2-methylsulfanylethyl (4R,5R)-4-(4-methoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methylsulfanylethyl (4R,5R)-4-(4-methoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-methylsulfanylethyl (4R,5R)-4-(4-methoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5R)-4-(4-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid 2-(methylthio)ethyl ester IUPAC Name: 2-methylsulfanylethyl (4R,5R)-4-(4-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5R)-2-keto-4-(4-methoxyphenyl)-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OCCSC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@H](C(=C)NC(=O)N2)C(=O)OCCSC

InChI

InChI=1S/C16H20N2O4S/c1-10-13(15(19)22-8-9-23-3)14(18-16(20)17-10)11-4-6-12(21-2)7-5-11/h4-7,13-14H,1,8-9H2,2-3H3,(H2,17,18,20)/t13-,14-/m0/s1