N-(1-adamantylmethyl)-5-chloranyl-2-[3-(2-diethylaminoethylamino)propyl]pyridine-4-carboxamide dihydrochloride

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-[3-(2-diethylaminoethylamino)propyl]pyridine-4-carboxamide dihydrochloride Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(2-diethylaminoethylamino)propyl]pyridine-4-carboxamide dihydrochloride CAS Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(2-diethylaminoethylamino)propyl]-4-pyridinecarboxamide dihydrochloride IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(2-diethylaminoethylamino)propyl]pyridine-4-carboxamide dihydrochloride Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-[3-(2-diethylaminoethylamino)propyl]isonicotinamide dihydrochloride Formula: C26H43Cl3N4O MolecularWeight: 534.00482

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNCCCC1=NC=C(C(=C1)C(=O)NCC23CC4CC(C2)CC(C4)C3)Cl.Cl.Cl

Isomeric SMILES

CCN(CC)CCNCCCC1=NC=C(C(=C1)C(=O)NCC23CC4CC(C2)CC(C4)C3)Cl.Cl.Cl

InChI

InChI=1S/C26H41ClN4O.2ClH/c1-3-31(4-2)9-8-28-7-5-6-22-13-23(24(27)17-29-22)25(32)30-18-26-14-19-10-20(15-26)12-21(11-19)16-26;;/h13,17,19-21,28H,3-12,14-16,18H2,1-2H3,(H,30,32);2*1H