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

Systemtic Name: (1S)-2-methyl-1-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine Openeye Name: (1S)-2-methyl-1-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine CAS Name: (1S)-2-methyl-1-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)-1-propanamine IUPAC Name: (1S)-2-methyl-1-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propan-1-amine Traditional Name: [(1S)-2-methyl-1-(3-methyl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium-1-yl)propyl]amine Formula: C14H18N3S+ MolecularWeight: 260.37782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3S/c1-8(2)12(15)13-16-9(3)14-17(13)10-6-4-5-7-11(10)18-14/h4-8,12H,15H2,1-3H3/p+1/t12-/m0/s1