[(1R)-3-methylsulfanyl-1-(1-pentylbenzimidazol-2-yl)propyl]azanium

Systemtic Name: [(1R)-3-methylsulfanyl-1-(1-pentylbenzimidazol-2-yl)propyl]azanium Openeye Name: [(1R)-3-methylsulfanyl-1-(1-pentylbenzimidazol-2-yl)propyl]ammonium CAS Name: [(1R)-3-(methylthio)-1-(1-pentyl-2-benzimidazolyl)propyl]ammonium IUPAC Name: [(1R)-3-methylsulfanyl-1-(1-pentylbenzimidazol-2-yl)propyl]azanium Traditional Name: [(1R)-1-(1-amylbenzimidazol-2-yl)-3-(methylthio)propyl]ammonium Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2N=C1C(CCSC)[NH3+]

Isomeric SMILES

CCCCCN1C2=CC=CC=C2N=C1[C@@H](CCSC)[NH3+]

InChI

InChI=1S/C16H25N3S/c1-3-4-7-11-19-15-9-6-5-8-14(15)18-16(19)13(17)10-12-20-2/h5-6,8-9,13H,3-4,7,10-12,17H2,1-2H3/p+1/t13-/m1/s1