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

Systemtic Name: 3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-morpholinosulfonylphenyl)propionamide Formula: C18H20BrF3N4O4S MolecularWeight: 525.34001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(F)(F)F)Br

InChI

InChI=1S/C18H20BrF3N4O4S/c1-12-16(19)17(18(20,21)22)24-26(12)7-6-15(27)23-13-2-4-14(5-3-13)31(28,29)25-8-10-30-11-9-25/h2-5H,6-11H2,1H3,(H,23,27)