N-[2-[3-bromanyl-5-[[1-butyl-3-ethyl-5-(hydroxymethyl)pyrazol-4-yl]methyl]-1-benzofuran-2-yl]phenyl]-1,1,1-tris(fluoranyl)methanesulfonamide

Systemtic Name: N-[2-[3-bromanyl-5-[[1-butyl-3-ethyl-5-(hydroxymethyl)pyrazol-4-yl]methyl]-1-benzofuran-2-yl]phenyl]-1,1,1-tris(fluoranyl)methanesulfonamide Openeye Name: N-[2-[3-bromo-5-[[1-butyl-3-ethyl-5-(hydroxymethyl)pyrazol-4-yl]methyl]benzofuran-2-yl]phenyl]-1,1,1-trifluoro-methanesulfonamide CAS Name: N-[2-[3-bromo-5-[[1-butyl-3-ethyl-5-(hydroxymethyl)-4-pyrazolyl]methyl]-2-benzofuranyl]phenyl]-1,1,1-trifluoromethanesulfonamide IUPAC Name: N-[2-[3-bromo-5-[[1-butyl-3-ethyl-5-(hydroxymethyl)pyrazol-4-yl]methyl]-1-benzofuran-2-yl]phenyl]-1,1,1-trifluoromethanesulfonamide Traditional Name: N-[2-[3-bromo-5-[(1-butyl-3-ethyl-5-methylol-pyrazol-4-yl)methyl]benzofuran-2-yl]phenyl]-1,1,1-trifluoro-methanesulfonamide Formula: C26H27BrF3N3O4S MolecularWeight: 614.47449

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)CC)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4NS(=O)(=O)C(F)(F)F)CO

Isomeric SMILES

CCCCN1C(=C(C(=N1)CC)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4NS(=O)(=O)C(F)(F)F)CO

InChI

InChI=1S/C26H27BrF3N3O4S/c1-3-5-12-33-22(15-34)18(20(4-2)31-33)13-16-10-11-23-19(14-16)24(27)25(37-23)17-8-6-7-9-21(17)32-38(35,36)26(28,29)30/h6-11,14,32,34H,3-5,12-13,15H2,1-2H3