3-[5-(3-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid

Systemtic Name: 3-[5-(3-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid Openeye Name: 3-[5-(3-methoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[5-(3-methoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-[5-(3-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid Traditional Name: 3-[4-keto-5-(3-methoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)O

InChI

InChI=1S/C16H14N2O4S/c1-22-11-4-2-3-10(7-11)12-8-23-15-14(12)16(21)18(9-17-15)6-5-13(19)20/h2-4,7-9H,5-6H2,1H3,(H,19,20)