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

Systemtic Name: N-(2-adamantyl)-2-[4-(2-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(2-adamantyl)-2-[4-(2-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[4-[(2-adamantylamino)-oxomethyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(2-adamantyl)-2-[4-(2-adamantylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(2-adamantyl)-2-[4-(2-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=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7C8CC9CC(C8)CC7C9

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7C8CC9CC(C8)CC7C9

InChI

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