2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[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:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

InChI

InChI=1S/C20H22BrF3N4O4S/c1-12(28-17(13-2-3-13)16(21)18(26-28)20(22,23)24)19(29)25-14-4-6-15(7-5-14)33(30,31)27-8-10-32-11-9-27/h4-7,12-13H,2-3,8-11H2,1H3,(H,25,29)