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

Systemtic Name: ethyl 2-[4-oxidanylidene-5-(4-phenylphenyl)thieno[2,3-d]pyrimidin-3-yl]butanoate Openeye Name: ethyl 2-[4-oxo-5-(4-phenylphenyl)thieno[2,3-d]pyrimidin-3-yl]butanoate CAS Name: 2-[4-oxo-5-(4-phenylphenyl)-3-thieno[2,3-d]pyrimidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-[4-oxo-5-(4-phenylphenyl)thieno[2,3-d]pyrimidin-3-yl]butanoate Traditional Name: 2-[4-keto-5-(4-phenylphenyl)thieno[2,3-d]pyrimidin-3-yl]butyric acid ethyl ester Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O3S/c1-3-20(24(28)29-4-2)26-15-25-22-21(23(26)27)19(14-30-22)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15,20H,3-4H2,1-2H3