2-[1-(2,5-diethoxy-4-piperidin-1-ylsulfonyl-phenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(2,5-diethoxy-4-piperidin-1-ylsulfonyl-phenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-[2,5-diethoxy-4-(1-piperidylsulfonyl)phenyl]sulfonyl-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-[2,5-diethoxy-4-(1-piperidinylsulfonyl)phenyl]sulfonyl-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(2,5-diethoxy-4-piperidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(2,5-diethoxy-4-piperidinosulfonyl-phenyl)sulfonyl-4-piperidyl]-1H-benzimidazole Formula: C27H36N4O6S2 MolecularWeight: 576.72794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3)OCC)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CCOC1=CC(=C(C=C1S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3)OCC)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C27H36N4O6S2/c1-3-36-23-19-26(24(37-4-2)18-25(23)38(32,33)30-14-8-5-9-15-30)39(34,35)31-16-12-20(13-17-31)27-28-21-10-6-7-11-22(21)29-27/h6-7,10-11,18-20H,3-5,8-9,12-17H2,1-2H3,(H,28,29)