N-(1-adamantylmethyl)-5-chloranyl-2-[2-(3-oxidanylpropylamino)ethyl]pyridine-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-[2-(3-oxidanylpropylamino)ethyl]pyridine-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-[2-(3-hydroxypropylamino)ethyl]pyridine-4-carboxamide CAS Name: N-(1-adamantylmethyl)-5-chloro-2-[2-(3-hydroxypropylamino)ethyl]-4-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-[2-(3-hydroxypropylamino)ethyl]pyridine-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-[2-(3-hydroxypropylamino)ethyl]isonicotinamide Formula: C22H32ClN3O2 MolecularWeight: 405.96138

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NC=C4Cl)CCNCCCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NC=C4Cl)CCNCCCO

InChI

InChI=1S/C22H32ClN3O2/c23-20-13-25-18(2-4-24-3-1-5-27)9-19(20)21(28)26-14-22-10-15-6-16(11-22)8-17(7-15)12-22/h9,13,15-17,24,27H,1-8,10-12,14H2,(H,26,28)