pentyl 2-[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: pentyl 2-[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: pentyl 2-[6-methyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[6-methyl-5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[6-methyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[4-keto-6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid amyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCOC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H24N2O3S/c1-4-5-6-11-26-17(24)12-23-13-22-20-19(21(23)25)18(15(3)27-20)16-9-7-14(2)8-10-16/h7-10,13H,4-6,11-12H2,1-3H3