Products 2098799-13-2

CAS 2098799-13-2 appears in our catalog under these names: Regorafenib Impurity 7, 4-(4-(3-(4-Chloro-3-(trifluoromethyl)phenyl)ureido)-3-(4-(3-(4-chloro-3-(trifluoromethyl)phenyl)ureido)-3-fluorophenoxy)phenoxy)-N-methylpicolinamide, 98%, Regorafenib (1-(4-Chloro-3-(trifluoromethyl)phenyl)urea)dimer, 4-ARYLUREA REGORAFENIB ANALOG. Offered by: Chemat Brand, TRC, Sigma-Aldrich. Available pack sizes: on request, 50mg, 25MG.

Structural formula: {0} (CAS {1})

4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-fluorophenoxy]phenoxy]-N-methylpyridine-2-carboxamide (CAS 2098799-13-2) is a chemical compound with the molecular formula C35H23Cl2F7N6O5 and a molecular weight of 811.5 g/mol. IUPAC name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-fluorophenoxy]phenoxy]-N-methylpyridine-2-carboxamide. InChIKey: QRLYAHWXHYKLQM-UHFFFAOYSA-N.

Identity
Molecular formulaC35H23Cl2F7N6O5
Molecular weight811.5 g/mol
IUPAC name4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-fluorophenoxy]phenoxy]-N-methylpyridine-2-carboxamide
InChIKeyQRLYAHWXHYKLQM-UHFFFAOYSA-N
SMILESCNC(=O)C1=NC=CC(=C1)OC2=CC(=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)OC4=CC(=C(C=C4)NC(=O)NC5=CC(=C(C=C5)Cl)C(F)(F)F)F

Computed by PubChem (NCBI)