N-(1-adamantylmethyl)-5-chloranyl-2-(piperidin-4-ylmethylamino)pyridine-4-carboxamide hydrochloride

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-(piperidin-4-ylmethylamino)pyridine-4-carboxamide hydrochloride Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-(4-piperidylmethylamino)pyridine-4-carboxamide hydrochloride CAS Name: N-(1-adamantylmethyl)-5-chloro-2-(4-piperidinylmethylamino)-4-pyridinecarboxamide hydrochloride IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-(piperidin-4-ylmethylamino)pyridine-4-carboxamide hydrochloride Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-(4-piperidylmethylamino)isonicotinamide hydrochloride Formula: C23H34Cl2N4O MolecularWeight: 453.44826

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CNC2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl.Cl

Isomeric SMILES

C1CNCCC1CNC2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl.Cl

InChI

InChI=1S/C23H33ClN4O.ClH/c24-20-13-27-21(26-12-15-1-3-25-4-2-15)8-19(20)22(29)28-14-23-9-16-5-17(10-23)7-18(6-16)11-23;/h8,13,15-18,25H,1-7,9-12,14H2,(H,26,27)(H,28,29);1H