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

Systemtic Name: 2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: 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)butanoate IUPAC Name: 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)butyrate Formula: C16H13N2O3S- MolecularWeight: 313.35102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)[O-])N1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S/c1-2-12(16(20)21)18-9-17-14-13(15(18)19)11(8-22-14)10-6-4-3-5-7-10/h3-9,12H,2H2,1H3,(H,20,21)/p-1