3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: 3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: 3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: 3-methyl-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]but-2-en-1-one Formula: C16H19F3N2O3S MolecularWeight: 376.39387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19F3N2O3S/c1-12(2)10-15(22)20-6-8-21(9-7-20)25(23,24)14-5-3-4-13(11-14)16(17,18)19/h3-5,10-11H,6-9H2,1-2H3