1-(4-ethanoylpiperazin-1-yl)-2-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]prop-2-en-1-one

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]prop-2-en-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[4-(2-isopropylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]prop-2-en-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[4-[(2-propan-2-ylphenyl)thio]-3-(trifluoromethyl)phenyl]-2-propen-1-one IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[4-(2-propan-2-ylphenyl)sulfanyl-3-(trifluoromethyl)phenyl]prop-2-en-1-one Traditional Name: 1-(4-acetylpiperazino)-2-[4-(o-cumenylthio)-3-(trifluoromethyl)phenyl]prop-2-en-1-one Formula: C25H27F3N2O2S MolecularWeight: 476.55429

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C(=C)C(=O)N3CCN(CC3)C(=O)C)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C(=C)C(=O)N3CCN(CC3)C(=O)C)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O2S/c1-16(2)20-7-5-6-8-22(20)33-23-10-9-19(15-21(23)25(26,27)28)17(3)24(32)30-13-11-29(12-14-30)18(4)31/h5-10,15-16H,3,11-14H2,1-2,4H3