(phenylmethyl) 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: (phenylmethyl) 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: benzyl 2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)butyric acid benzyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)N2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)N2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C19H20N2O3S/c1-4-15(19(23)24-10-14-8-6-5-7-9-14)21-11-20-17-16(18(21)22)12(2)13(3)25-17/h5-9,11,15H,4,10H2,1-3H3