4-bromanyl-2-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-(4-pyrrolidinosulfonylphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C16H16BrF3N4O3S MolecularWeight: 481.28745

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H16BrF3N4O3S/c1-23-13(12(17)14(22-23)16(18,19)20)15(25)21-10-4-6-11(7-5-10)28(26,27)24-8-2-3-9-24/h4-7H,2-3,8-9H2,1H3,(H,21,25)