4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzenecarbonitrile bromide

Systemtic Name: 4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzenecarbonitrile bromide Openeye Name: 4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzonitrile bromide CAS Name: 4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzonitrile bromide IUPAC Name: 4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzonitrile bromide Traditional Name: 4-(1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-4-ium-3-yl)benzonitrile bromide Formula: C19H16BrN3S MolecularWeight: 398.31944

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2=C(N(C=C2C3=CC=C(C=C3)C#N)C4=CC=CC=C4)SC1.[Br-]

Isomeric SMILES

C1C[N+]2=C(N(C=C2C3=CC=C(C=C3)C#N)C4=CC=CC=C4)SC1.[Br-]

InChI

InChI=1S/C19H16N3S.BrH/c20-13-15-7-9-16(10-8-15)18-14-22(17-5-2-1-3-6-17)19-21(18)11-4-12-23-19;/h1-3,5-10,14H,4,11-12H2;1H/q+1;/p-1