3-(4-oxidanylidene-6-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid

Systemtic Name: 3-(4-oxidanylidene-6-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[4-oxo-6-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[4-oxo-6-phenyl-2-(3-pyridinyl)-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-(4-oxo-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[4-keto-6-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)CCC(=O)O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)CCC(=O)O)C4=CN=CC=C4

InChI

InChI=1S/C20H15N3O3S/c24-17(25)8-10-23-18(14-7-4-9-21-12-14)22-19-15(20(23)26)11-16(27-19)13-5-2-1-3-6-13/h1-7,9,11-12H,8,10H2,(H,24,25)