N-[[2,6-bis(fluoranyl)phenyl]methyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-[[2,6-bis(fluoranyl)phenyl]methyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-[(2,6-difluorophenyl)methyl]-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-[(2,6-difluorophenyl)methyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-[(2,6-difluorophenyl)methyl]-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2,6-difluorobenzyl)-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C21H17F2N3O2S2 MolecularWeight: 445.505386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NCC4=C(C=CC=C4F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NCC4=C(C=CC=C4F)F

InChI

InChI=1S/C21H17F2N3O2S2/c22-17-8-4-9-18(23)16(17)12-24-30(27,28)20-14-26(13-15-6-2-1-3-7-15)25-21(20)19-10-5-11-29-19/h1-11,14,24H,12-13H2