4-[[2-methyl-2-(4-pyrazin-2-ylpiperazin-1-yl)propanoyl]amino]adamantane-1-carboxamide

Systemtic Name: 4-[[2-methyl-2-(4-pyrazin-2-ylpiperazin-1-yl)propanoyl]amino]adamantane-1-carboxamide Openeye Name: 4-[[2-methyl-2-(4-pyrazin-2-ylpiperazin-1-yl)propanoyl]amino]adamantane-1-carboxamide CAS Name: 4-[[2-methyl-1-oxo-2-[4-(2-pyrazinyl)-1-piperazinyl]propyl]amino]-1-adamantanecarboxamide IUPAC Name: 4-[[2-methyl-2-(4-pyrazin-2-ylpiperazin-1-yl)propanoyl]amino]adamantane-1-carboxamide Traditional Name: 4-[[2-methyl-2-(4-pyrazin-2-ylpiperazino)propanoyl]amino]adamantane-1-carboxamide Formula: C23H34N6O2 MolecularWeight: 426.55506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)N)N4CCN(CC4)C5=NC=CN=C5

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)N)N4CCN(CC4)C5=NC=CN=C5

InChI

InChI=1S/C23H34N6O2/c1-22(2,29-7-5-28(6-8-29)18-14-25-3-4-26-18)21(31)27-19-16-9-15-10-17(19)13-23(11-15,12-16)20(24)30/h3-4,14-17,19H,5-13H2,1-2H3,(H2,24,30)(H,27,31)