[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [6-chloro-1-(2-hydroxyethyl)-2-benzimidazolyl]methyl-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl-methyl-[4-(methylthio)benzyl]ammonium Formula: C19H23ClN3OS+ MolecularWeight: 376.92342

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC3=C(N2CCO)C=C(C=C3)Cl

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC3=C(N2CCO)C=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3OS/c1-22(12-14-3-6-16(25-2)7-4-14)13-19-21-17-8-5-15(20)11-18(17)23(19)9-10-24/h3-8,11,24H,9-10,12-13H2,1-2H3/p+1