3-(5,6-dimethyl-4-oxidanylidene-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid

Systemtic Name: 3-(5,6-dimethyl-4-oxidanylidene-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-[5,6-dimethyl-4-oxo-2-(2-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[5,6-dimethyl-4-oxo-2-(2-pyridinyl)-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-(5,6-dimethyl-4-oxo-2-pyridin-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-[4-keto-5,6-dimethyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CC=CC=N3)CCC(=O)O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CC=CC=N3)CCC(=O)O)C

InChI

InChI=1S/C16H15N3O3S/c1-9-10(2)23-15-13(9)16(22)19(8-6-12(20)21)14(18-15)11-5-3-4-7-17-11/h3-5,7H,6,8H2,1-2H3,(H,20,21)