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

Systemtic Name: ethyl 6-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyloxymethyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethoxy]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[2-(1,3-benzoxazol-2-ylthio)acetyl]oxymethyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H21N3O6S/c1-2-30-21(28)19-16(24-22(29)26-20(19)14-8-4-3-5-9-14)12-31-18(27)13-33-23-25-15-10-6-7-11-17(15)32-23/h3-11,20H,2,12-13H2,1H3,(H2,24,26,29)