N-butan-2-yl-2-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butan-2-yl-2-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-butan-2-yl-2-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]acetamide Traditional Name: 2-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazino]-N-sec-butyl-acetamide Formula: C17H23ClF3N3O3S MolecularWeight: 441.89603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClF3N3O3S/c1-3-12(2)22-16(25)11-23-6-8-24(9-7-23)28(26,27)15-10-13(17(19,20)21)4-5-14(15)18/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,22,25)