1-ethyl-5-piperidin-1-ylsulfonyl-2-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]benzimidazole

Systemtic Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]benzimidazole Openeye Name: 1-ethyl-5-(1-piperidylsulfonyl)-2-[[4-(2-pyridylmethyl)piperazin-1-yl]methyl]benzimidazole CAS Name: 1-ethyl-5-(1-piperidinylsulfonyl)-2-[[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]benzimidazole IUPAC Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]benzimidazole Traditional Name: 1-ethyl-5-piperidinosulfonyl-2-[[4-(2-pyridylmethyl)piperazino]methyl]benzimidazole Formula: C25H34N6O2S MolecularWeight: 482.64146

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCN(CC4)CC5=CC=CC=N5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCN(CC4)CC5=CC=CC=N5

InChI

InChI=1S/C25H34N6O2S/c1-2-31-24-10-9-22(34(32,33)30-12-6-3-7-13-30)18-23(24)27-25(31)20-29-16-14-28(15-17-29)19-21-8-4-5-11-26-21/h4-5,8-11,18H,2-3,6-7,12-17,19-20H2,1H3