N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-tert-butylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C20H24N3OS+ MolecularWeight: 354.48906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C

InChI

InChI=1S/C20H23N3OS/c1-20(2,3)14-9-11-15(12-10-14)21-18(24)13-25-19-22-16-7-5-6-8-17(16)23(19)4/h5-12H,13H2,1-4H3,(H,21,24)/p+1