2-(1-methylimidazol-2-yl)sulfanylquinoline-4-carboxylic acid

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanylquinoline-4-carboxylic acid Openeye Name: 2-(1-methylimidazol-2-yl)sulfanylquinoline-4-carboxylic acid CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-4-quinolinecarboxylic acid IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanylquinoline-4-carboxylic acid Traditional Name: 2-[(1-methylimidazol-2-yl)thio]cinchoninic acid Formula: C14H11N3O2S MolecularWeight: 285.32104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CN1C=CN=C1SC2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C14H11N3O2S/c1-17-7-6-15-14(17)20-12-8-10(13(18)19)9-4-2-3-5-11(9)16-12/h2-8H,1H3,(H,18,19)