2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanethioamide

Systemtic Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanethioamide Openeye Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]thioacetamide CAS Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanethioamide IUPAC Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanethioamide Traditional Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]thioacetamide Formula: C19H28N3S+ MolecularWeight: 330.51072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)CCC3CCCCC3)CC(=S)N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)CCC3CCCCC3)CC(=S)N

InChI

InChI=1S/C19H27N3S/c1-13-10-16-17(11-14(13)2)22(12-18(20)23)19(21-16)9-8-15-6-4-3-5-7-15/h10-11,15H,3-9,12H2,1-2H3,(H2,20,23)/p+1