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

Systemtic Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(4-ethoxyphenyl)azanium bromide Openeye Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-(4-ethoxyphenyl)ammonium bromide CAS Name: [4-(2-acetamido-4-methyl-5-thiazolyl)-2-thiazolyl]-(4-ethoxyphenyl)ammonium bromide IUPAC Name: [4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-(4-ethoxyphenyl)azanium bromide Traditional Name: [4-(2-acetamido-4-methyl-thiazol-5-yl)thiazol-2-yl]-p-phenetyl-ammonium bromide Formula: C17H19BrN4O2S2 MolecularWeight: 455.39236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)[NH2+]C2=NC(=CS2)C3=C(N=C(S3)NC(=O)C)C.[Br-]

Isomeric SMILES

CCOC1=CC=C(C=C1)[NH2+]C2=NC(=CS2)C3=C(N=C(S3)NC(=O)C)C.[Br-]

InChI

InChI=1S/C17H18N4O2S2.BrH/c1-4-23-13-7-5-12(6-8-13)20-16-21-14(9-24-16)15-10(2)18-17(25-15)19-11(3)22;/h5-9H,4H2,1-3H3,(H,20,21)(H,18,19,22);1H