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

Systemtic Name: 3-(5-tert-butyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)propanoic acid Openeye Name: 3-(5-tert-butyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)propanoic acid CAS Name: 3-(5-tert-butyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)propanoic acid IUPAC Name: 3-(5-tert-butyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)propanoic acid Traditional Name: 3-(5-tert-butyl-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl)propionic acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC2=C1C(=O)NC(=N2)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CSC2=C1C(=O)NC(=N2)CCC(=O)O

InChI

InChI=1S/C13H16N2O3S/c1-13(2,3)7-6-19-12-10(7)11(18)14-8(15-12)4-5-9(16)17/h6H,4-5H2,1-3H3,(H,16,17)(H,14,15,18)