N-methyl-1-(2-methylpropyl)-2-(phenylmethyl)sulfinyl-benzimidazol-1-ium-1-amine

Systemtic Name: N-methyl-1-(2-methylpropyl)-2-(phenylmethyl)sulfinyl-benzimidazol-1-ium-1-amine Openeye Name: 2-benzylsulfinyl-1-isobutyl-N-methyl-benzimidazol-1-ium-1-amine CAS Name: N-methyl-1-(2-methylpropyl)-2-(phenylmethyl)sulfinyl-1-benzimidazol-1-iumamine IUPAC Name: 2-benzylsulfinyl-N-methyl-1-(2-methylpropyl)benzimidazol-1-ium-1-amine Traditional Name: (2-benzylsulfinyl-1-isobutyl-benzimidazol-1-ium-1-yl)-methyl-amine Formula: C19H24N3OS+ MolecularWeight: 342.47836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1(C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=C3)NC

Isomeric SMILES

CC(C)C[N+]1(C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=C3)NC

InChI

InChI=1S/C19H24N3OS/c1-15(2)13-22(20-3)18-12-8-7-11-17(18)21-19(22)24(23)14-16-9-5-4-6-10-16/h4-12,15,20H,13-14H2,1-3H3/q+1