2-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]piperidin-3-yl]-1H-benzimidazole

Systemtic Name: 2-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]piperidin-3-yl]-1H-benzimidazole Openeye Name: 2-[1-[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]-3-piperidyl]-1H-benzimidazole CAS Name: 2-[1-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]-3-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]piperidin-3-yl]-1H-benzimidazole Traditional Name: 2-[1-[5-(4-methylpiperazino)sulfonyl-2-pyridyl]-3-piperidyl]-1H-benzimidazole Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N3CCCC(C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N3CCCC(C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H28N6O2S/c1-26-11-13-28(14-12-26)31(29,30)18-8-9-21(23-15-18)27-10-4-5-17(16-27)22-24-19-6-2-3-7-20(19)25-22/h2-3,6-9,15,17H,4-5,10-14,16H2,1H3,(H,24,25)