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

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-[3-(1-piperidinylsulfonyl)phenyl]-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-(3-piperidinosulfonylphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C21H20F3N5O3S MolecularWeight: 479.47541

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H20F3N5O3S/c22-21(23,24)17-9-2-3-10-19(17)29-14-18(26-27-29)20(30)25-15-7-6-8-16(13-15)33(31,32)28-11-4-1-5-12-28/h2-3,6-10,13-14H,1,4-5,11-12H2,(H,25,30)