N-[3,4-bis(fluoranyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(3,4-difluorophenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(3,4-difluorophenyl)-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(3,4-difluorophenyl)-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(3,4-difluorophenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C20H13F3N4O MolecularWeight: 382.33863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=C(C=N2)C(=O)NC3=CC(=C(C=C3)F)F)N4C=CC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=C(C=N2)C(=O)NC3=CC(=C(C=C3)F)F)N4C=CC=C4)F

InChI

InChI=1S/C20H13F3N4O/c21-15-8-7-13(11-17(15)23)25-19(28)14-12-24-27(18-6-2-1-5-16(18)22)20(14)26-9-3-4-10-26/h1-12H,(H,25,28)