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

Systemtic Name: 3-(4-oxidanylidene-2-propan-2-yl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[2-isopropyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-(4-oxo-2-propan-2-yl-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(4-oxo-2-propan-2-yl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[2-isopropyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H16N2O3S2 MolecularWeight: 348.43984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CCC(=O)O

Isomeric SMILES

CC(C)C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CCC(=O)O

InChI

InChI=1S/C16H16N2O3S2/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)