N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-fluoranyl-benzamide Openeye Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-fluoro-benzamide CAS Name: N-[2-[(4-tert-butylphenyl)methyl]-3-pyrazolyl]-2-fluorobenzamide IUPAC Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-fluorobenzamide Traditional Name: N-[2-(4-tert-butylbenzyl)pyrazol-3-yl]-2-fluoro-benzamide Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC=CC=C3F

InChI

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