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

Systemtic Name: 4-(4H-1,4-benzothiazin-3-yl)-3-(4-chlorophenyl)-5-methyl-1H-imidazol-3-ium-2-thiol bromide Openeye Name: 4-(4H-1,4-benzothiazin-3-yl)-3-(4-chlorophenyl)-5-methyl-1H-imidazol-3-ium-2-thiol bromide CAS Name: 4-(4H-1,4-benzothiazin-3-yl)-3-(4-chlorophenyl)-5-methyl-1H-imidazol-3-ium-2-thiol bromide IUPAC Name: 4-(4H-1,4-benzothiazin-3-yl)-3-(4-chlorophenyl)-5-methyl-1H-imidazol-3-ium-2-thiol bromide Traditional Name: 4-(4H-1,4-benzothiazin-3-yl)-3-(4-chlorophenyl)-5-methyl-1H-imidazol-3-ium-2-thiol bromide Formula: C18H15BrClN3S2 MolecularWeight: 452.8188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN3S2.BrH/c1-11-17(15-10-24-16-5-3-2-4-14(16)21-15)22(18(23)20-11)13-8-6-12(19)7-9-13;/h2-10,21H,1H3,(H,20,23);1H