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

Systemtic Name: ethyl 6-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyloxymethyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethoxy]methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]oxymethyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[2-(1,3-benzoxazol-2-ylthio)acetyl]oxymethyl]-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H23N3O7S MolecularWeight: 497.52032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O7S/c1-3-32-22(29)20-17(25-23(30)27-21(20)14-8-10-15(31-2)11-9-14)12-33-19(28)13-35-24-26-16-6-4-5-7-18(16)34-24/h4-11,21H,3,12-13H2,1-2H3,(H2,25,27,30)