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

Systemtic Name: N-[2-(4-cyclohexylpiperazin-1-yl)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-(4-cyclohexylpiperazin-1-yl)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-[2-(4-cyclohexyl-1-piperazinyl)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-[2-(4-cyclohexylpiperazin-1-yl)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-[2-(4-cyclohexylpiperazino)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C26H34N5OS+ MolecularWeight: 464.64606

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=CC=CC=C3N4CCN(CC4)C5CCCCC5

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=CC=CC=C3N4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C26H33N5OS/c1-29-23-13-7-5-11-21(23)28-26(29)33-19-25(32)27-22-12-6-8-14-24(22)31-17-15-30(16-18-31)20-9-3-2-4-10-20/h5-8,11-14,20H,2-4,9-10,15-19H2,1H3,(H,27,32)/p+1