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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)O

InChI

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