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

Systemtic Name: 2-[4-[(3-oxidanyl-1-adamantyl)carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[[(3-hydroxy-1-adamantyl)-oxomethyl]amino]phenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C30H29N5O3 MolecularWeight: 507.58296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)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/C30H29N5O3/c36-27(35-25-3-1-2-10-31-25)21-6-9-23-24(12-21)34-26(33-23)20-4-7-22(8-5-20)32-28(37)29-13-18-11-19(14-29)16-30(38,15-18)17-29/h1-10,12,18-19,38H,11,13-17H2,(H,32,37)(H,33,34)(H,31,35,36)