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

Systemtic Name: N-(1-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(1-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(1-adamantyl)-2-[4-[(1-adamantylamino)-oxomethyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(1-adamantyl)-2-[4-(1-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(1-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)(C3)NC(=O)C4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC78CC9CC(C7)CC(C9)C8

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC78CC9CC(C7)CC(C9)C8

InChI

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