4-[[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide

Systemtic Name: 4-[[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide Openeye Name: 4-[[4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]amino]benzoic acid hydrobromide CAS Name: 4-[[4-(2-acetamido-4-methyl-5-thiazolyl)-2-thiazolyl]amino]benzoic acid hydrobromide IUPAC Name: 4-[[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide Traditional Name: 4-[[4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]amino]benzoic acid hydrobromide Formula: C16H15BrN4O3S2 MolecularWeight: 455.3493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O.Br

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O.Br

InChI

InChI=1S/C16H14N4O3S2.BrH/c1-8-13(25-16(17-8)18-9(2)21)12-7-24-15(20-12)19-11-5-3-10(4-6-11)14(22)23;/h3-7H,1-2H3,(H,19,20)(H,22,23)(H,17,18,21);1H