N-(1-adamantylmethyl)-5-chloranyl-2-(1,4-diazepan-1-yl)pyridine-4-carboxamide hydrochloride

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-2-(1,4-diazepan-1-yl)pyridine-4-carboxamide hydrochloride Openeye Name: N-(1-adamantylmethyl)-5-chloro-2-(1,4-diazepan-1-yl)pyridine-4-carboxamide hydrochloride CAS Name: N-(1-adamantylmethyl)-5-chloro-2-(1,4-diazepan-1-yl)-4-pyridinecarboxamide hydrochloride IUPAC Name: N-(1-adamantylmethyl)-5-chloro-2-(1,4-diazepan-1-yl)pyridine-4-carboxamide hydrochloride Traditional Name: N-(1-adamantylmethyl)-5-chloro-2-(1,4-diazepan-1-yl)isonicotinamide hydrochloride Formula: C22H32Cl2N4O MolecularWeight: 439.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl.Cl

Isomeric SMILES

C1CNCCN(C1)C2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl.Cl

InChI

InChI=1S/C22H31ClN4O.ClH/c23-19-13-25-20(27-4-1-2-24-3-5-27)9-18(19)21(28)26-14-22-10-15-6-16(11-22)8-17(7-15)12-22;/h9,13,15-17,24H,1-8,10-12,14H2,(H,26,28);1H