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

Systemtic Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-imidazole-2-thione Openeye Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-imidazole-2-thione CAS Name: 3-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1H-imidazole-2-thione IUPAC Name: 3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-imidazole-2-thione Traditional Name: 1-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-4-imidazoline-2-thione Formula: C12H22N3S+ MolecularWeight: 240.38818

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCN2C=CNC2=S

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCN2C=CNC2=S

InChI

InChI=1S/C12H21N3S/c1-11-5-2-3-7-14(11)8-4-9-15-10-6-13-12(15)16/h6,10-11H,2-5,7-9H2,1H3,(H,13,16)/p+1/t11-/m0/s1