N-(1-adamantylmethyl)-3-chloranyl-2-piperazin-1-yl-pyridine-4-carboxamide hydrochloride

Systemtic Name: N-(1-adamantylmethyl)-3-chloranyl-2-piperazin-1-yl-pyridine-4-carboxamide hydrochloride Openeye Name: N-(1-adamantylmethyl)-3-chloro-2-piperazin-1-yl-pyridine-4-carboxamide hydrochloride CAS Name: N-(1-adamantylmethyl)-3-chloro-2-(1-piperazinyl)-4-pyridinecarboxamide hydrochloride IUPAC Name: N-(1-adamantylmethyl)-3-chloro-2-piperazin-1-ylpyridine-4-carboxamide hydrochloride Traditional Name: N-(1-adamantylmethyl)-3-chloro-2-piperazino-isonicotinamide hydrochloride Formula: C21H30Cl2N4O MolecularWeight: 425.3951

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC(=C2Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4.Cl

Isomeric SMILES

C1CN(CCN1)C2=NC=CC(=C2Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4.Cl

InChI

InChI=1S/C21H29ClN4O.ClH/c22-18-17(1-2-24-19(18)26-5-3-23-4-6-26)20(27)25-13-21-10-14-7-15(11-21)9-16(8-14)12-21;/h1-2,14-16,23H,3-13H2,(H,25,27);1H