N-cycloheptyl-2-[4-(pyridin-3-ylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-cycloheptyl-2-[4-(pyridin-3-ylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-cycloheptyl-2-[4-[[oxo(3-pyridinyl)methyl]amino]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-cycloheptyl-2-(4-nicotinamidophenyl)-3H-benzimidazole-5-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C27H27N5O2/c33-26(29-21-7-3-1-2-4-8-21)19-11-14-23-24(16-19)32-25(31-23)18-9-12-22(13-10-18)30-27(34)20-6-5-15-28-17-20/h5-6,9-17,21H,1-4,7-8H2,(H,29,33)(H,30,34)(H,31,32)