N-[6-[4-(2-methylpropanoyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[6-[4-(2-methylpropanoyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide Openeye Name: N-[6-[4-(2-methylpropanoyl)piperazin-1-yl]-3-pyridyl]adamantane-1-carboxamide CAS Name: N-[6-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-3-pyridinyl]-1-adamantanecarboxamide IUPAC Name: N-[6-[4-(2-methylpropanoyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide Traditional Name: N-[6-(4-isobutyrylpiperazino)-3-pyridyl]adamantane-1-carboxamide Formula: C24H34N4O2 MolecularWeight: 410.55236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=NC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=NC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34N4O2/c1-16(2)22(29)28-7-5-27(6-8-28)21-4-3-20(15-25-21)26-23(30)24-12-17-9-18(13-24)11-19(10-17)14-24/h3-4,15-19H,5-14H2,1-2H3,(H,26,30)