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

Systemtic Name: ethyl 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: ethyl 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butyric acid ethyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S/c1-3-14(18(22)23-4-2)20-11-19-16-15(17(20)21)13(10-24-16)12-8-6-5-7-9-12/h5-11,14H,3-4H2,1-2H3