1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one

Systemtic Name: 1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Openeye Name: 1-(4-styrylsulfonylpiperazin-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one CAS Name: 1-[4-(2-phenylethenylsulfonyl)-1-piperazinyl]-3-[3-(trifluoromethyl)phenyl]-2-propen-1-one IUPAC Name: 1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Traditional Name: 1-(4-styrylsulfonylpiperazino)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Formula: C22H21F3N2O3S MolecularWeight: 450.47395

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C=CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C22H21F3N2O3S/c23-22(24,25)20-8-4-7-19(17-20)9-10-21(28)26-12-14-27(15-13-26)31(29,30)16-11-18-5-2-1-3-6-18/h1-11,16-17H,12-15H2