N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]adamantane-1-carboxamide Openeye Name: N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]adamantane-1-carboxamide CAS Name: N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]-1-adamantanecarboxamide IUPAC Name: N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]adamantane-1-carboxamide Traditional Name: N-[2-(2,5-dimethylphenyl)-3H-benzimidazol-5-yl]adamantane-1-carboxamide Formula: C26H29N3O MolecularWeight: 399.52796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=C(N2)C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=C(N2)C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H29N3O/c1-15-3-4-16(2)21(7-15)24-28-22-6-5-20(11-23(22)29-24)27-25(30)26-12-17-8-18(13-26)10-19(9-17)14-26/h3-7,11,17-19H,8-10,12-14H2,1-2H3,(H,27,30)(H,28,29)