3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylazanium

Systemtic Name: 3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylazanium Openeye Name: 3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylammonium CAS Name: 3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylammonium IUPAC Name: 3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylazanium Traditional Name: 3-(3-phenyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylammonium Formula: C18H19N3S+2 MolecularWeight: 309.42856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3[N+](=C(N2)CCC[NH3+])C4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3[N+](=C(N2)CCC[NH3+])C4=CC=CC=C4S3

InChI

InChI=1S/C18H17N3S/c19-12-6-11-16-20-17(13-7-2-1-3-8-13)18-21(16)14-9-4-5-10-15(14)22-18/h1-5,7-10H,6,11-12,19H2/p+2