dimethyl 2-[1,7-dimethoxy-1,7-bis(oxidanylidene)-4-phenylsulfanyl-heptan-4-yl]pyrimidine-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[1,7-dimethoxy-1,7-bis(oxidanylidene)-4-phenylsulfanyl-heptan-4-yl]pyrimidine-4,5-dicarboxylate Openeye Name: dimethyl 2-[4-methoxy-1-(3-methoxy-3-oxo-propyl)-4-oxo-1-phenylsulfanyl-butyl]pyrimidine-4,5-dicarboxylate CAS Name: 2-[1,7-dimethoxy-1,7-dioxo-4-(phenylthio)heptan-4-yl]pyrimidine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1,7-dimethoxy-1,7-dioxo-4-phenylsulfanylheptan-4-yl)pyrimidine-4,5-dicarboxylate Traditional Name: 2-[4-keto-1-(3-keto-3-methoxy-propyl)-4-methoxy-1-(phenylthio)butyl]pyrimidine-4,5-dicarboxylic acid dimethyl ester Formula: C23H26N2O8S MolecularWeight: 490.52614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC(=O)OC)(C1=NC=C(C(=N1)C(=O)OC)C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(CCC(=O)OC)(C1=NC=C(C(=N1)C(=O)OC)C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C23H26N2O8S/c1-30-17(26)10-12-23(13-11-18(27)31-2,34-15-8-6-5-7-9-15)22-24-14-16(20(28)32-3)19(25-22)21(29)33-4/h5-9,14H,10-13H2,1-4H3