2-[4-[(4-oxidanylidene-1-adamantyl)carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-[(4-oxidanylidene-1-adamantyl)carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-[(4-oxoadamantane-1-carbonyl)amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[[oxo-(4-oxo-1-adamantyl)methyl]amino]phenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-[(4-oxoadamantane-1-carbonyl)amino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-[(4-ketoadamantane-1-carbonyl)amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C30H27N5O3 MolecularWeight: 505.56708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3=O)C(=O)NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7

Isomeric SMILES

C1C2CC3CC(C2)(CC1C3=O)C(=O)NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7

InChI

InChI=1S/C30H27N5O3/c36-26-20-11-17-12-21(26)16-30(14-17,15-20)29(38)32-22-7-4-18(5-8-22)27-33-23-9-6-19(13-24(23)34-27)28(37)35-25-3-1-2-10-31-25/h1-10,13,17,20-21H,11-12,14-16H2,(H,32,38)(H,33,34)(H,31,35,37)