ethyl 4-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 3-oxo-4-[4-oxo-3-(p-tolylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-butanoate CAS Name: 4-[[3-[(4-methylphenyl)methyl]-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-methylphenyl)methyl]-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 3-keto-4-[[4-keto-3-(4-methylbenzyl)thieno[3,2-d]pyrimidin-2-yl]thio]butyric acid ethyl ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)C)SC=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)C)SC=C2

InChI

InChI=1S/C20H20N2O4S2/c1-3-26-17(24)10-15(23)12-28-20-21-16-8-9-27-18(16)19(25)22(20)11-14-6-4-13(2)5-7-14/h4-9H,3,10-12H2,1-2H3