2-(1-ethyl-5,7-dimethyl-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(1-ethyl-5,7-dimethyl-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)sulfanylethanoic acid Openeye Name: 2-(1-ethyl-5,7-dimethyl-4-oxo-pyrido[2,3-d]pyrimidin-2-yl)sulfanylacetic acid CAS Name: 2-[(1-ethyl-5,7-dimethyl-4-oxo-2-pyrido[2,3-d]pyrimidinyl)thio]acetic acid IUPAC Name: 2-(1-ethyl-5,7-dimethyl-4-oxopyrido[2,3-d]pyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-[(1-ethyl-4-keto-5,7-dimethyl-pyrido[2,3-d]pyrimidin-2-yl)thio]acetic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC(=N2)C)C)C(=O)N=C1SCC(=O)O

Isomeric SMILES

CCN1C2=C(C(=CC(=N2)C)C)C(=O)N=C1SCC(=O)O

InChI

InChI=1S/C13H15N3O3S/c1-4-16-11-10(7(2)5-8(3)14-11)12(19)15-13(16)20-6-9(17)18/h5H,4,6H2,1-3H3,(H,17,18)