2-(3-methoxypyridin-2-yl)-4-sulfanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-(3-methoxypyridin-2-yl)-4-sulfanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-(3-methoxy-2-pyridyl)-4-thioxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-(3-methoxy-2-pyridinyl)-4-sulfanylidene-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-(3-methoxypyridin-2-yl)-4-sulfanylidene-1H-quinazoline-6-carboxylic acid Traditional Name: 2-(3-methoxy-2-pyridyl)-4-thioxo-1H-quinazoline-6-carboxylic acid Formula: C15H11N3O3S MolecularWeight: 313.33114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)C2=NC(=S)C3=C(N2)C=CC(=C3)C(=O)O

Isomeric SMILES

COC1=C(N=CC=C1)C2=NC(=S)C3=C(N2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C15H11N3O3S/c1-21-11-3-2-6-16-12(11)13-17-10-5-4-8(15(19)20)7-9(10)14(22)18-13/h2-7H,1H3,(H,19,20)(H,17,18,22)