2-chloranyl-N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 2-chloro-N-[3-(6-morpholinopyridazin-3-yl)phenyl]-5-(trifluoromethyl)benzenesulfonamide CAS Name: 2-chloro-N-[3-[6-(4-morpholinyl)-3-pyridazinyl]phenyl]-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 2-chloro-N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-chloro-N-[3-(6-morpholinopyridazin-3-yl)phenyl]-5-(trifluoromethyl)benzenesulfonamide Formula: C21H18ClF3N4O3S MolecularWeight: 498.90583

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(C=C2)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1COCCN1C2=NN=C(C=C2)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C21H18ClF3N4O3S/c22-17-5-4-15(21(23,24)25)13-19(17)33(30,31)28-16-3-1-2-14(12-16)18-6-7-20(27-26-18)29-8-10-32-11-9-29/h1-7,12-13,28H,8-11H2