2-[1-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(5-pyrrolidinosulfonyl-2-pyridyl)-4-piperidyl]-1H-benzimidazole Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O2S/c27-29(28,26-11-3-4-12-26)17-7-8-20(22-15-17)25-13-9-16(10-14-25)21-23-18-5-1-2-6-19(18)24-21/h1-2,5-8,15-16H,3-4,9-14H2,(H,23,24)