[(3S)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpiperidin-3-yl]-(2-fluorophenyl)methanone

Systemtic Name: [(3S)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpiperidin-3-yl]-(2-fluorophenyl)methanone Openeye Name: [(3S)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-piperidyl]-(2-fluorophenyl)methanone CAS Name: [(3S)-1-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-3-piperidinyl]-(2-fluorophenyl)methanone IUPAC Name: [(3S)-1-(5-tert-butyl-2-methylpyrazole-3-carbonyl)piperidin-3-yl]-(2-fluorophenyl)methanone Traditional Name: [(3S)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-piperidyl]-(2-fluorophenyl)methanone Formula: C21H26FN3O2 MolecularWeight: 371.448443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCC(C2)C(=O)C3=CC=CC=C3F)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC=CC=C3F)C

InChI

InChI=1S/C21H26FN3O2/c1-21(2,3)18-12-17(24(4)23-18)20(27)25-11-7-8-14(13-25)19(26)15-9-5-6-10-16(15)22/h5-6,9-10,12,14H,7-8,11,13H2,1-4H3/t14-/m0/s1