(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl quinoline-2-carboxylate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl quinoline-2-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C17H11N3O3S MolecularWeight: 337.35254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C17H11N3O3S/c21-16-15-12(7-8-24-15)19-14(20-16)9-23-17(22)13-6-5-10-3-1-2-4-11(10)18-13/h1-8H,9H2,(H,19,20,21)