1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoranyl-5-methyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoranyl-5-methyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoro-5-methyl-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-(2-fluoro-5-methyl-phenyl)pyrazole-3-carboxamide Formula: C22H24FN3O2 MolecularWeight: 381.443263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)F)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H24FN3O2/c1-15-5-10-18(23)20(13-15)24-21(27)19-11-12-26(25-19)14-28-17-8-6-16(7-9-17)22(2,3)4/h5-13H,14H2,1-4H3,(H,24,27)