3-(6-aminocarbonyl-5-methyl-4-oxidanylidene-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: 3-(6-aminocarbonyl-5-methyl-4-oxidanylidene-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-[6-carbamoyl-5-methyl-4-oxo-2-(2-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[6-carbamoyl-5-methyl-4-oxo-2-(2-pyridinyl)-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-(6-carbamoyl-5-methyl-4-oxo-2-pyridin-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-[6-carbamoyl-4-keto-5-methyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C16H13N4O4S- MolecularWeight: 357.36382

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O4S/c1-8-11-15(25-12(8)13(17)23)19-14(9-4-2-3-6-18-9)20(16(11)24)7-5-10(21)22/h2-4,6H,5,7H2,1H3,(H2,17,23)(H,21,22)/p-1