2-(1,3-thiazol-2-ylamino)quinoline-4-carboxylic acid

Systemtic Name: 2-(1,3-thiazol-2-ylamino)quinoline-4-carboxylic acid Openeye Name: 2-(thiazol-2-ylamino)quinoline-4-carboxylic acid CAS Name: 2-(2-thiazolylamino)-4-quinolinecarboxylic acid IUPAC Name: 2-(1,3-thiazol-2-ylamino)quinoline-4-carboxylic acid Traditional Name: 2-(thiazol-2-ylamino)cinchoninic acid Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)NC3=NC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)NC3=NC=CS3)C(=O)O

InChI

InChI=1S/C13H9N3O2S/c17-12(18)9-7-11(16-13-14-5-6-19-13)15-10-4-2-1-3-8(9)10/h1-7H,(H,17,18)(H,14,15,16)