ethyl 2-(2-methylsulfanylethoxymethyl)-4-oxidanylidene-5-phenylmethoxy-1H-pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-(2-methylsulfanylethoxymethyl)-4-oxidanylidene-5-phenylmethoxy-1H-pyrimidine-6-carboxylate Openeye Name: ethyl 5-benzyloxy-2-(2-methylsulfanylethoxymethyl)-4-oxo-1H-pyrimidine-6-carboxylate CAS Name: 2-[2-(methylthio)ethoxymethyl]-4-oxo-5-phenylmethoxy-1H-pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-methylsulfanylethoxymethyl)-4-oxo-5-phenylmethoxy-1H-pyrimidine-6-carboxylate Traditional Name: 5-benzoxy-4-keto-2-[2-(methylthio)ethoxymethyl]-1H-pyrimidine-6-carboxylic acid ethyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N=C(N1)COCCSC)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N=C(N1)COCCSC)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O5S/c1-3-24-18(22)15-16(25-11-13-7-5-4-6-8-13)17(21)20-14(19-15)12-23-9-10-26-2/h4-8H,3,9-12H2,1-2H3,(H,19,20,21)