2-phenoxyethyl 2-methyl-3-(4-oxidanyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)propanoate

Systemtic Name: 2-phenoxyethyl 2-methyl-3-(4-oxidanyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)propanoate Openeye Name: 2-phenoxyethyl 3-(4-hydroxy-6-oxo-2-thioxo-hexahydropyrimidin-5-yl)-2-methyl-propanoate CAS Name: 3-(4-hydroxy-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)-2-methylpropanoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 3-(4-hydroxy-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)-2-methylpropanoate Traditional Name: 3-(4-hydroxy-6-keto-2-thioxo-hexahydropyrimidin-5-yl)-2-methyl-propionic acid 2-phenoxyethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C(NC(=S)NC1=O)O)C(=O)OCCOC2=CC=CC=C2

Isomeric SMILES

CC(CC1C(NC(=S)NC1=O)O)C(=O)OCCOC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O5S/c1-10(9-12-13(19)17-16(24)18-14(12)20)15(21)23-8-7-22-11-5-3-2-4-6-11/h2-6,10,12-13,19H,7-9H2,1H3,(H2,17,18,20,24)