N-[5-(azepan-1-ylsulfonyl)-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]furan-2-carboxamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]furan-2-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]furan-2-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]-2-furancarboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]furan-2-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]-2-furamide Formula: C19H21F3N2O5S MolecularWeight: 446.44065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC=CO3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC=CO3

InChI

InChI=1S/C19H21F3N2O5S/c20-19(21,22)13-29-16-8-7-14(30(26,27)24-9-3-1-2-4-10-24)12-15(16)23-18(25)17-6-5-11-28-17/h5-8,11-12H,1-4,9-10,13H2,(H,23,25)