[(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [(2R)-2-(dimethylamino)-3-ethylpentyl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [(2R)-2-(dimethylamino)-3-ethylpentyl]-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[4-(methylthio)benzyl]ammonium Formula: C17H31N2S+ MolecularWeight: 295.50644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C[NH2+]CC1=CC=C(C=C1)SC)N(C)C

Isomeric SMILES

CCC(CC)[C@H](C[NH2+]CC1=CC=C(C=C1)SC)N(C)C

InChI

InChI=1S/C17H30N2S/c1-6-15(7-2)17(19(3)4)13-18-12-14-8-10-16(20-5)11-9-14/h8-11,15,17-18H,6-7,12-13H2,1-5H3/p+1/t17-/m0/s1