[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(3-methylphenyl)azanium bromide

Systemtic Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(3-methylphenyl)azanium bromide Openeye Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-(m-tolyl)ammonium bromide CAS Name: [4-(2-acetamido-4-methyl-5-thiazolyl)-2-thiazolyl]-(3-methylphenyl)ammonium bromide IUPAC Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(3-methylphenyl)azanium bromide Traditional Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-(m-tolyl)ammonium bromide Formula: C16H17BrN4OS2 MolecularWeight: 425.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)[NH2+]C2=NC(=CS2)C3=C(N=C(S3)NC(=O)C)C.[Br-]

Isomeric SMILES

CC1=CC(=CC=C1)[NH2+]C2=NC(=CS2)C3=C(N=C(S3)NC(=O)C)C.[Br-]

InChI

InChI=1S/C16H16N4OS2.BrH/c1-9-5-4-6-12(7-9)19-15-20-13(8-22-15)14-10(2)17-16(23-14)18-11(3)21;/h4-8H,1-3H3,(H,19,20)(H,17,18,21);1H