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T20

Summary
Name:3-nitro-N-{1-phenyl-5-[(piperidin-1-yl)methyl]-1H-1,3-benzimidazol-2-yl}benzamide
Formula:C26 H25 N5 O3
Formal charge:0
Formula weight:455.508 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs14.523-nitro-N-{1-phenyl-5-[(piperidin-1-yl)methyl]-1H-1,3-benzimidazol-2-yl}benzamide
OpenEye OEToolkits3.1.0.03-nitro-~{N}-[1-phenyl-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52[O-][N+](=O)c1cccc(c1)C(=O)Nc1nc2cc(CN3CCCCC3)ccc2n1c1ccccc1
InChIInChI1.06InChI=1S/C26H25N5O3/c32-25(20-8-7-11-22(17-20)31(33)34)28-26-27-23-16-19(18-29-14-5-2-6-15-29)12-13-24(23)30(26)21-9-3-1-4-10-21/h1,3-4,7-13,16-17H,2,5-6,14-15,18H2,(H,27,28,32)
InChIKeyInChI1.06IEOZVBDPTHRYGK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385[O-][N+](=O)c1cccc(c1)C(=O)Nc2nc3cc(CN4CCCCC4)ccc3n2c5ccccc5
SMILESCACTVS3.385[O-][N+](=O)c1cccc(c1)C(=O)Nc2nc3cc(CN4CCCCC4)ccc3n2c5ccccc5
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc(cc1)n2c3ccc(cc3nc2NC(=O)c4cccc(c4)[N+](=O)[O-])CN5CCCCC5
SMILESOpenEye OEToolkits3.1.0.0c1ccc(cc1)n2c3ccc(cc3nc2NC(=O)c4cccc(c4)[N+](=O)[O-])CN5CCCCC5

256448

PDB entries from 2026-07-15

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