3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-benzimidazole-2-thione

Systemtic Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-benzimidazole-2-thione Openeye Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-benzimidazole-2-thione CAS Name: 3-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1H-benzimidazole-2-thione IUPAC Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-benzimidazole-2-thione Traditional Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-benzimidazole-2-thione Formula: C16H24N3S+ MolecularWeight: 290.44686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCN2C3=CC=CC=C3NC2=S

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCN2C3=CC=CC=C3NC2=S

InChI

InChI=1S/C16H23N3S/c1-13-7-4-5-10-18(13)11-6-12-19-15-9-3-2-8-14(15)17-16(19)20/h2-3,8-9,13H,4-7,10-12H2,1H3,(H,17,20)/p+1/t13-/m0/s1