2-(5-nitroimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoic acid

Systemtic Name: 2-(5-nitroimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoic acid Openeye Name: 2-(5-nitroimidazo[2,1-b]thiazol-6-yl)sulfanylbenzoic acid CAS Name: 2-[(5-nitro-6-imidazo[2,1-b]thiazolyl)thio]benzoic acid IUPAC Name: 2-(5-nitroimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoic acid Traditional Name: 2-[(5-nitroimidazo[2,1-b]thiazol-6-yl)thio]benzoic acid Formula: C12H7N3O4S2 MolecularWeight: 321.33168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SC2=C(N3C=CSC3=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SC2=C(N3C=CSC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H7N3O4S2/c16-11(17)7-3-1-2-4-8(7)21-9-10(15(18)19)14-5-6-20-12(14)13-9/h1-6H,(H,16,17)