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

Systemtic Name: N-cycloheptyl-2-[4-(pyridin-4-ylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-cycloheptyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-cycloheptyl-2-[4-[[oxo(pyridin-4-yl)methyl]amino]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-cycloheptyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-cycloheptyl-2-(4-isonicotinamidophenyl)-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=CC=NC=C5

Isomeric SMILES

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

InChI

InChI=1S/C27H27N5O2/c33-26(19-13-15-28-16-14-19)30-22-10-7-18(8-11-22)25-31-23-12-9-20(17-24(23)32-25)27(34)29-21-5-3-1-2-4-6-21/h7-17,21H,1-6H2,(H,29,34)(H,30,33)(H,31,32)