N-[4-phenyl-1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-but-3-yn-2-yl]hydroxylamine

Systemtic Name: N-[4-phenyl-1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-but-3-yn-2-yl]hydroxylamine Openeye Name: N-[3-phenyl-1-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylmethyl]prop-2-ynyl]hydroxylamine CAS Name: N-[4-phenyl-1-[[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]but-3-yn-2-yl]hydroxylamine IUPAC Name: N-[4-phenyl-1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylbut-3-yn-2-yl]hydroxylamine Traditional Name: N-[3-phenyl-1-[[4-[4-(trifluoromethyl)phenyl]piperazino]sulfonylmethyl]prop-2-ynyl]hydroxylamine Formula: C21H22F3N3O3S MolecularWeight: 453.47789

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C(F)(F)F)S(=O)(=O)CC(C#CC3=CC=CC=C3)NO

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C(F)(F)F)S(=O)(=O)CC(C#CC3=CC=CC=C3)NO

InChI

InChI=1S/C21H22F3N3O3S/c22-21(23,24)18-7-10-20(11-8-18)26-12-14-27(15-13-26)31(29,30)16-19(25-28)9-6-17-4-2-1-3-5-17/h1-5,7-8,10-11,19,25,28H,12-16H2