N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H18ClF3N4O3S MolecularWeight: 498.90583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F)Cl

InChI

InChI=1S/C21H18ClF3N4O3S/c22-17-9-8-14(12-18(17)33(31,32)28-10-4-5-11-28)27-20(30)16-13-26-29(19(16)21(23,24)25)15-6-2-1-3-7-15/h1-3,6-9,12-13H,4-5,10-11H2,(H,27,30)