2-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonyl-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(4-pyrrolidinosulfonylphenyl)sulfonyl-4-piperidyl]-1H-benzimidazole Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H26N4O4S2/c27-31(28,25-13-3-4-14-25)18-7-9-19(10-8-18)32(29,30)26-15-11-17(12-16-26)22-23-20-5-1-2-6-21(20)24-22/h1-2,5-10,17H,3-4,11-16H2,(H,23,24)