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

Systemtic Name: pentyl 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: pentyl 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[5-(3,4-dimethylphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[5-(3,4-dimethylphenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-3-yl]acetic acid amyl ester Formula: C22H26N2O3S MolecularWeight: 398.51844

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3S/c1-5-6-7-10-27-18(25)12-24-13-23-21-20(22(24)26)19(16(4)28-21)17-9-8-14(2)15(3)11-17/h8-9,11,13H,5-7,10,12H2,1-4H3