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

Systemtic Name: N-[1-[4-(4-fluorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[4-(4-fluorophenyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[4-(4-fluorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C26H36FN3O2 MolecularWeight: 441.581343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36FN3O2/c1-17(2)23(28-25(32)26-14-18-11-19(15-26)13-20(12-18)16-26)24(31)30-9-7-29(8-10-30)22-5-3-21(27)4-6-22/h3-6,17-20,23H,7-16H2,1-2H3,(H,28,32)