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

Systemtic Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(4-methoxyphenyl)azanium bromide Openeye Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-(4-methoxyphenyl)ammonium bromide CAS Name: [4-(2-acetamido-4-methyl-5-thiazolyl)-2-thiazolyl]-(4-methoxyphenyl)ammonium bromide IUPAC Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(4-methoxyphenyl)azanium bromide Traditional Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-(4-methoxyphenyl)ammonium bromide Formula: C16H17BrN4O2S2 MolecularWeight: 441.36578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)C2=CSC(=N2)[NH2+]C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)C2=CSC(=N2)[NH2+]C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C16H16N4O2S2.BrH/c1-9-14(24-16(17-9)18-10(2)21)13-8-23-15(20-13)19-11-4-6-12(22-3)7-5-11;/h4-8H,1-3H3,(H,19,20)(H,17,18,21);1H