(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-methylbenzoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-methylbenzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C15H12N2O3S MolecularWeight: 300.33238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C15H12N2O3S/c1-9-2-4-10(5-3-9)15(19)20-8-12-16-11-6-7-21-13(11)14(18)17-12/h2-7H,8H2,1H3,(H,16,17,18)