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

Systemtic Name: 2-[2-fluoranyl-4-[[(3R,5S)-4-oxidanylidene-1-adamantyl]carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[2-fluoro-4-[[(3R,5S)-4-oxoadamantane-1-carbonyl]amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[2-fluoro-4-[[oxo-[(3R,5S)-4-oxo-1-adamantyl]methyl]amino]phenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[2-fluoro-4-[[(3R,5S)-4-oxoadamantane-1-carbonyl]amino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[2-fluoro-4-[[(3R,5S)-4-ketoadamantane-1-carbonyl]amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C30H26FN5O3 MolecularWeight: 523.557543

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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)F

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2=O)CC1C3)C(=O)NC4=CC(=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)F

InChI

InChI=1S/C30H26FN5O3/c31-22-12-20(33-29(39)30-13-16-9-18(14-30)26(37)19(10-16)15-30)5-6-21(22)27-34-23-7-4-17(11-24(23)35-27)28(38)36-25-3-1-2-8-32-25/h1-8,11-12,16,18-19H,9-10,13-15H2,(H,33,39)(H,34,35)(H,32,36,38)/t16?,18-,19+,30?