ethyl (4R)-6-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[2-(1,3-benzoxazol-2-ylthio)acetyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H19N3O6S/c1-3-25-16(23)15-10(2)19-17(24)20-12(15)8-26-14(22)9-28-18-21-11-6-4-5-7-13(11)27-18/h4-7,10H,3,8-9H2,1-2H3,(H2,19,20,24)/t10-/m1/s1