4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide

Systemtic Name: 4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide Openeye Name: 4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide CAS Name: 4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide IUPAC Name: 4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide Traditional Name: 4-(4H-1,4-benzothiazin-3-yl)-5-methyl-3-phenyl-1H-imidazol-3-ium-2-thiol bromide Formula: C18H16BrN3S2 MolecularWeight: 418.37374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C(N1)S)C2=CC=CC=C2)C3=CSC4=CC=CC=C4N3.[Br-]

Isomeric SMILES

CC1=C([N+](=C(N1)S)C2=CC=CC=C2)C3=CSC4=CC=CC=C4N3.[Br-]

InChI

InChI=1S/C18H15N3S2.BrH/c1-12-17(15-11-23-16-10-6-5-9-14(16)20-15)21(18(22)19-12)13-7-3-2-4-8-13;/h2-11,20H,1H3,(H,19,22);1H