propyl 2-[5-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate

Systemtic Name: propyl 2-[5-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate Openeye Name: propyl 2-[5-(3,4-dimethylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]butanoate CAS Name: 2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]butanoic acid propyl ester IUPAC Name: propyl 2-[5-(3,4-dimethylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]butanoate Traditional Name: 2-[5-(3,4-dimethylphenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]butyric acid propyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CC)N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCOC(=O)C(CC)N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)C)C

InChI

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