N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-(3-cyclopentylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C21H19F3N4O3S MolecularWeight: 464.46077

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H19F3N4O3S/c22-21(23,24)17-10-3-4-11-19(17)28-13-18(26-27-28)20(29)25-14-6-5-9-16(12-14)32(30,31)15-7-1-2-8-15/h3-6,9-13,15H,1-2,7-8H2,(H,25,29)