propyl 4-[[5-(4-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate

Systemtic Name: propyl 4-[[5-(4-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Openeye Name: propyl 4-[[5-(4-methoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate CAS Name: 4-[[5-(4-methoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Traditional Name: 4-[[4-keto-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]methyl]benzoic acid propyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H22N2O4S/c1-3-12-30-24(28)18-6-4-16(5-7-18)13-26-15-25-22-21(23(26)27)20(14-31-22)17-8-10-19(29-2)11-9-17/h4-11,14-15H,3,12-13H2,1-2H3