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

Systemtic Name: N-(2-adamantyl)-2-[4-(1-adamantylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-(2-adamantyl)-3H-benzimidazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[4-[[1-adamantyl(oxo)methyl]amino]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-(2-adamantyl)-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-(2-adamantyl)-3H-benzimidazole-5-carboxamide Formula: C35H40N4O2 MolecularWeight: 548.7177

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C78CC9CC(C7)CC(C9)C8

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C78CC9CC(C7)CC(C9)C8

InChI

InChI=1S/C35H40N4O2/c40-33(39-31-26-11-19-7-20(13-26)14-27(31)12-19)25-3-6-29-30(15-25)38-32(37-29)24-1-4-28(5-2-24)36-34(41)35-16-21-8-22(17-35)10-23(9-21)18-35/h1-6,15,19-23,26-27,31H,7-14,16-18H2,(H,36,41)(H,37,38)(H,39,40)