N-[(2S)-butan-2-yl]-2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)pyrazole-3-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)-N-[(1S)-1-methylpropyl]pyrazole-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)pyrazole-3-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-5-(2-fluorophenyl)-N-[(1S)-1-methylpropyl]pyrazole-3-carboxamide Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3F

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3F

InChI

InChI=1S/C22H24FN3O/c1-5-16(4)24-22(27)21-13-19(17-8-6-7-9-18(17)23)25-26(21)20-11-10-14(2)12-15(20)3/h6-13,16H,5H2,1-4H3,(H,24,27)/t16-/m0/s1