5-[2,2-bis(fluoranyl)ethyl]-N-[(4-tert-butylphenyl)methyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 5-[2,2-bis(fluoranyl)ethyl]-N-[(4-tert-butylphenyl)methyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-5-(2,2-difluoroethyl)-2-methyl-pyrazole-3-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-5-(2,2-difluoroethyl)-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-5-(2,2-difluoroethyl)-2-methylpyrazole-3-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-5-(2,2-difluoroethyl)-2-methyl-pyrazole-3-carboxamide Formula: C18H23F2N3O MolecularWeight: 335.391526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=O)C2=CC(=NN2C)CC(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=O)C2=CC(=NN2C)CC(F)F

InChI

InChI=1S/C18H23F2N3O/c1-18(2,3)13-7-5-12(6-8-13)11-21-17(24)15-9-14(10-16(19)20)22-23(15)4/h5-9,16H,10-11H2,1-4H3,(H,21,24)