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

Systemtic Name: 3-(4-oxidanylidene-2-propyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[4-oxo-2-propyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-(4-oxo-2-propyl-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(4-oxo-2-propyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[4-keto-2-propyl-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:

CCCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CCC(=O)O

Isomeric SMILES

CCCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CCC(=O)O

InChI

InChI=1S/C16H16N2O3S2/c1-2-4-12-17-15-14(16(21)18(12)7-6-13(19)20)10(9-23-15)11-5-3-8-22-11/h3,5,8-9H,2,4,6-7H2,1H3,(H,19,20)