4-oxidanylidene-3-pyridin-2-yl-2-sulfanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-pyridin-2-yl-2-sulfanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 4-oxo-3-(2-pyridyl)-2-thioxo-1H-quinazoline-7-carboxylic acid CAS Name: 4-oxo-3-(2-pyridinyl)-2-sulfanylidene-1H-quinazoline-7-carboxylic acid IUPAC Name: 4-oxo-3-pyridin-2-yl-2-sulfanylidene-1H-quinazoline-7-carboxylic acid Traditional Name: 4-keto-3-(2-pyridyl)-2-thioxo-1H-quinazoline-7-carboxylic acid Formula: C14H9N3O3S MolecularWeight: 299.30456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)O)NC2=S

Isomeric SMILES

C1=CC=NC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)O)NC2=S

InChI

InChI=1S/C14H9N3O3S/c18-12-9-5-4-8(13(19)20)7-10(9)16-14(21)17(12)11-3-1-2-6-15-11/h1-7H,(H,16,21)(H,19,20)