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

Systemtic Name: N-(2-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(2-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[4-[(1-adamantylamino)-oxomethyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(2-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(2-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-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)C(=O)NC78CC9CC(C7)CC(C9)C8

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)NC78CC9CC(C7)CC(C9)C8

InChI

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