3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholinosulfonylphenyl)propionamide Formula: C20H22BrF3N4O4S MolecularWeight: 551.37729

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C(F)(F)F)Br

InChI

InChI=1S/C20H22BrF3N4O4S/c21-17-18(13-1-2-13)28(26-19(17)20(22,23)24)8-7-16(29)25-14-3-5-15(6-4-14)33(30,31)27-9-11-32-12-10-27/h3-6,13H,1-2,7-12H2,(H,25,29)