2-[4-[[(5S,7R)-3-bromanyl-1-adamantyl]carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-[[(5S,7R)-3-bromanyl-1-adamantyl]carbonylamino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-[[(5S,7R)-3-bromoadamantane-1-carbonyl]amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[[[(5S,7R)-3-bromo-1-adamantyl]-oxomethyl]amino]phenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-[[(5S,7R)-3-bromoadamantane-1-carbonyl]amino]phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-[[(5S,7R)-3-bromoadamantane-1-carbonyl]amino]phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C30H28BrN5O2 MolecularWeight: 570.47962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Br)C(=O)NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7

InChI

InChI=1S/C30H28BrN5O2/c31-30-15-18-11-19(16-30)14-29(13-18,17-30)28(38)33-22-7-4-20(5-8-22)26-34-23-9-6-21(12-24(23)35-26)27(37)36-25-3-1-2-10-32-25/h1-10,12,18-19H,11,13-17H2,(H,33,38)(H,34,35)(H,32,36,37)/t18-,19+,29?,30?