N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C25H24FN5O2 MolecularWeight: 445.488763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

InChI

InChI=1S/C25H24FN5O2/c1-25(2,3)29-22(32)17-10-12-18(13-11-17)28-23(33)19-16-27-31(21-9-5-4-8-20(21)26)24(19)30-14-6-7-15-30/h4-16H,1-3H3,(H,28,33)(H,29,32)