N-(1-adamantylmethyl)-N-(5-chloranylpiperazin-2-yl)pyridine-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-N-(5-chloranylpiperazin-2-yl)pyridine-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-N-(5-chloropiperazin-2-yl)pyridine-4-carboxamide CAS Name: N-(1-adamantylmethyl)-N-(5-chloro-2-piperazinyl)-4-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-N-(5-chloropiperazin-2-yl)pyridine-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-N-(5-chloropiperazin-2-yl)isonicotinamide Formula: C21H29ClN4O MolecularWeight: 388.93416

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN(C4CNC(CN4)Cl)C(=O)C5=CC=NC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN(C4CNC(CN4)Cl)C(=O)C5=CC=NC=C5

InChI

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