3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine

Systemtic Name: 3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine Openeye Name: 3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine CAS Name: 3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)-1-propanamine IUPAC Name: 3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine Traditional Name: 3-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propylamine Formula: C13H16N3S+ MolecularWeight: 246.35124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2[N+](=C(N1)CCCN)C3=CC=CC=C3S2

Isomeric SMILES

CC1=C2[N+](=C(N1)CCCN)C3=CC=CC=C3S2

InChI

InChI=1S/C13H15N3S/c1-9-13-16(12(15-9)7-4-8-14)10-5-2-3-6-11(10)17-13/h2-3,5-6H,4,7-8,14H2,1H3/p+1