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

Systemtic Name: 3-[5-(furan-2-yl)-4-oxidanylidene-2-propan-2-yl-thieno[2,3-d]pyrimidin-3-yl]propanoic acid Openeye Name: 3-[5-(2-furyl)-2-isopropyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[5-(2-furanyl)-4-oxo-2-propan-2-yl-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-[5-(furan-2-yl)-4-oxo-2-propan-2-ylthieno[2,3-d]pyrimidin-3-yl]propanoic acid Traditional Name: 3-[5-(2-furyl)-2-isopropyl-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C(=CS2)C3=CC=CO3)C(=O)N1CCC(=O)O

Isomeric SMILES

CC(C)C1=NC2=C(C(=CS2)C3=CC=CO3)C(=O)N1CCC(=O)O

InChI

InChI=1S/C16H16N2O4S/c1-9(2)14-17-15-13(16(21)18(14)6-5-12(19)20)10(8-23-15)11-4-3-7-22-11/h3-4,7-9H,5-6H2,1-2H3,(H,19,20)