(3R)-1-[(2-methylsulfanylbenzimidazol-1-yl)methyl]piperidin-1-ium-3-ol

Systemtic Name: (3R)-1-[(2-methylsulfanylbenzimidazol-1-yl)methyl]piperidin-1-ium-3-ol Openeye Name: (3R)-1-[(2-methylsulfanylbenzimidazol-1-yl)methyl]piperidin-1-ium-3-ol CAS Name: (3R)-1-[[2-(methylthio)-1-benzimidazolyl]methyl]-3-piperidin-1-iumol IUPAC Name: (3R)-1-[(2-methylsulfanylbenzimidazol-1-yl)methyl]piperidin-1-ium-3-ol Traditional Name: (3R)-1-[[2-(methylthio)benzimidazol-1-yl]methyl]piperidin-1-ium-3-ol Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=CC=C2N1C[NH+]3CCCC(C3)O

Isomeric SMILES

CSC1=NC2=CC=CC=C2N1C[NH+]3CCC[C@H](C3)O

InChI

InChI=1S/C14H19N3OS/c1-19-14-15-12-6-2-3-7-13(12)17(14)10-16-8-4-5-11(18)9-16/h2-3,6-7,11,18H,4-5,8-10H2,1H3/p+1/t11-/m1/s1