N-[3,4-bis(fluoranyl)phenyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3,4-difluorophenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(3,4-difluorophenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3,4-difluorophenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3,4-difluorophenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C21H15F2N3OS MolecularWeight: 395.425106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC(=C(C=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C21H15F2N3OS/c22-17-9-8-15(11-18(17)23)24-21(27)16-13-26(12-14-5-2-1-3-6-14)25-20(16)19-7-4-10-28-19/h1-11,13H,12H2,(H,24,27)