(2S)-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-methyl-butanamide

Systemtic Name: (2S)-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-methyl-butanamide Openeye Name: (2S)-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-methyl-butanamide CAS Name: (2S)-N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-methylbutanamide IUPAC Name: (2S)-N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-methylbutanamide Traditional Name: (2S)-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-methyl-butyramide Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)C(=O)NCC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H22FN3O/c1-3-15(2)21(26)23-13-17-14-25(19-7-5-4-6-8-19)24-20(17)16-9-11-18(22)12-10-16/h4-12,14-15H,3,13H2,1-2H3,(H,23,26)/t15-/m0/s1