N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-hexyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C18H26F3N3O3S MolecularWeight: 421.47755

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H26F3N3O3S/c1-2-3-4-5-9-22-17(25)23-10-12-24(13-11-23)28(26,27)16-8-6-7-15(14-16)18(19,20)21/h6-8,14H,2-5,9-13H2,1H3,(H,22,25)