3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide

Systemtic Name: 3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide Openeye Name: 3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide CAS Name: 3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide IUPAC Name: 3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide Traditional Name: 3-methyl-4-phenyl-1,2-dihydropyrido[2,1-b][1,3]benzothiazol-10-ium bromide Formula: C18H16BrNS MolecularWeight: 358.29534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](CC1)C3=CC=CC=C3S2)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=C(C2=[N+](CC1)C3=CC=CC=C3S2)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C18H16NS.BrH/c1-13-11-12-19-15-9-5-6-10-16(15)20-18(19)17(13)14-7-3-2-4-8-14;/h2-10H,11-12H2,1H3;1H/q+1;/p-1