[5-(1-adamantyl)-2-methyl-pyrazol-3-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: [5-(1-adamantyl)-2-methyl-pyrazol-3-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: [5-(1-adamantyl)-2-methyl-pyrazol-3-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone CAS Name: [5-(1-adamantyl)-2-methyl-3-pyrazolyl]-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: [5-(1-adamantyl)-2-methylpyrazol-3-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: [5-(1-adamantyl)-2-methyl-pyrazol-3-yl]-[4-(2-fluorophenyl)piperazino]methanone Formula: C25H31FN4O MolecularWeight: 422.538243

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C23CC4CC(C2)CC(C4)C3)C(=O)N5CCN(CC5)C6=CC=CC=C6F

Isomeric SMILES

CN1C(=CC(=N1)C23CC4CC(C2)CC(C4)C3)C(=O)N5CCN(CC5)C6=CC=CC=C6F

InChI

InChI=1S/C25H31FN4O/c1-28-22(13-23(27-28)25-14-17-10-18(15-25)12-19(11-17)16-25)24(31)30-8-6-29(7-9-30)21-5-3-2-4-20(21)26/h2-5,13,17-19H,6-12,14-16H2,1H3