N-[3-methyl-1-oxidanylidene-1-[4-(phenylcarbonyl)piperazin-1-yl]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[4-(phenylcarbonyl)piperazin-1-yl]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-(4-benzoylpiperazine-1-carbonyl)-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-(4-benzoyl-1-piperazinyl)-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-(4-benzoylpiperazin-1-yl)-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-(4-benzoylpiperazine-1-carbonyl)-2-methyl-propyl]adamantane-1-carboxamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O3/c1-18(2)23(28-26(33)27-15-19-12-20(16-27)14-21(13-19)17-27)25(32)30-10-8-29(9-11-30)24(31)22-6-4-3-5-7-22/h3-7,18-21,23H,8-17H2,1-2H3,(H,28,33)