3-[bis(fluoranyl)methyl]-5-(4-morpholin-4-ylphenyl)-2-pyrazol-1-yl-benzenesulfonamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(4-morpholin-4-ylphenyl)-2-pyrazol-1-yl-benzenesulfonamide Openeye Name: 3-(difluoromethyl)-5-(4-morpholinophenyl)-2-pyrazol-1-yl-benzenesulfonamide CAS Name: 3-(difluoromethyl)-5-[4-(4-morpholinyl)phenyl]-2-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 3-(difluoromethyl)-5-(4-morpholin-4-ylphenyl)-2-pyrazol-1-ylbenzenesulfonamide Traditional Name: 3-(difluoromethyl)-5-(4-morpholinophenyl)-2-pyrazol-1-yl-benzenesulfonamide Formula: C20H20F2N4O3S MolecularWeight: 434.459606

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C3=CC(=C(C(=C3)S(=O)(=O)N)N4C=CC=N4)C(F)F

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C3=CC(=C(C(=C3)S(=O)(=O)N)N4C=CC=N4)C(F)F

InChI

InChI=1S/C20H20F2N4O3S/c21-20(22)17-12-15(13-18(30(23,27)28)19(17)26-7-1-6-24-26)14-2-4-16(5-3-14)25-8-10-29-11-9-25/h1-7,12-13,20H,8-11H2,(H2,23,27,28)