1-(4-ethanoylpiperazin-1-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]ethanone Formula: C22H31N5O4S2 MolecularWeight: 493.64264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C22H31N5O4S2/c1-3-27-20-8-7-18(33(30,31)26-9-5-4-6-10-26)15-19(20)23-22(27)32-16-21(29)25-13-11-24(12-14-25)17(2)28/h7-8,15H,3-6,9-14,16H2,1-2H3