3-nitro-5-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]benzene-1,2-diol hydrobromide

Systemtic Name: 3-nitro-5-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]benzene-1,2-diol hydrobromide Openeye Name: 3-nitro-5-[2-(3-quinolylamino)thiazol-4-yl]benzene-1,2-diol hydrobromide CAS Name: 3-nitro-5-[2-(3-quinolinylamino)-4-thiazolyl]benzene-1,2-diol hydrobromide IUPAC Name: 3-nitro-5-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]benzene-1,2-diol hydrobromide Traditional Name: 3-nitro-5-[2-(3-quinolylamino)thiazol-4-yl]pyrocatechol hydrobromide Formula: C18H13BrN4O4S MolecularWeight: 461.28922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC(=CS3)C4=CC(=C(C(=C4)O)O)[N+](=O)[O-].Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC(=CS3)C4=CC(=C(C(=C4)O)O)[N+](=O)[O-].Br

InChI

InChI=1S/C18H12N4O4S.BrH/c23-16-7-11(6-15(17(16)24)22(25)26)14-9-27-18(21-14)20-12-5-10-3-1-2-4-13(10)19-8-12;/h1-9,23-24H,(H,20,21);1H