2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-N-pentan-2-yl-ethanamide

Systemtic Name: 2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-N-pentan-2-yl-ethanamide Openeye Name: 2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-N-(1-methylbutyl)acetamide CAS Name: 2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-N-pentan-2-ylacetamide IUPAC Name: 2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-N-pentan-2-ylacetamide Traditional Name: 2-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazino]-N-(1-methylbutyl)acetamide Formula: C19H25F6N3O3S MolecularWeight: 489.475519

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H25F6N3O3S/c1-3-4-13(2)26-17(29)12-27-5-7-28(8-6-27)32(30,31)16-10-14(18(20,21)22)9-15(11-16)19(23,24)25/h9-11,13H,3-8,12H2,1-2H3,(H,26,29)