methyl-[(2-methylsulfanylbenzimidazol-1-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(2-methylsulfanylbenzimidazol-1-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(2-methylsulfanylbenzimidazol-1-yl)methyl]ammonium CAS Name: methyl-[[2-(methylthio)-1-benzimidazolyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(2-methylsulfanylbenzimidazol-1-yl)methyl]azanium Traditional Name: benzyl-methyl-[[2-(methylthio)benzimidazol-1-yl]methyl]ammonium Formula: C17H20N3S+ MolecularWeight: 298.4258

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CN2C3=CC=CC=C3N=C2SC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CN2C3=CC=CC=C3N=C2SC

InChI

InChI=1S/C17H19N3S/c1-19(12-14-8-4-3-5-9-14)13-20-16-11-7-6-10-15(16)18-17(20)21-2/h3-11H,12-13H2,1-2H3/p+1