N-[[4-(pyridin-3-ylmethylcarbamoyl)phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-(pyridin-3-ylmethylcarbamoyl)phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-(3-pyridylmethylcarbamoyl)phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-(pyridin-3-ylmethylcarbamoyl)phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-(3-pyridylmethylcarbamoyl)benzyl]adamantane-1-carboxamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C25H29N3O2/c29-23(27-16-18-2-1-7-26-14-18)22-5-3-17(4-6-22)15-28-24(30)25-11-19-8-20(12-25)10-21(9-19)13-25/h1-7,14,19-21H,8-13,15-16H2,(H,27,29)(H,28,30)