2-[1-keto-4-(4-methyl-3-piperidinosulfonyl-phenyl)phthalazin-2-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide

SpectraBase Compound ID	DjkMdtymGi8
InChI	InChI=1S/C29H27F3N4O5S/c1-19-9-10-20(17-25(19)42(39,40)35-15-5-2-6-16-35)27-23-7-3-4-8-24(23)28(38)36(34-27)18-26(37)33-21-11-13-22(14-12-21)41-29(30,31)32/h3-4,7-14,17H,2,5-6,15-16,18H2,1H3,(H,33,37)
InChIKey	LWBLXVVSJHCBLT-UHFFFAOYSA-N Google Search
Mol Weight	600.61 g/mol
Molecular Formula	C29H27F3N4O5S
Exact Mass	600.165426 g/mol

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SpectraBase Spectrum ID	HvFHY59E2qY
Name	2-[1-keto-4-(4-methyl-3-piperidinosulfonyl-phenyl)phthalazin-2-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H27F3N4O5S
InChI	InChI=1S/C29H27F3N4O5S/c1-19-9-10-20(17-25(19)42(39,40)35-15-5-2-6-16-35)27-23-7-3-4-8-24(23)28(38)36(34-27)18-26(37)33-21-11-13-22(14-12-21)41-29(30,31)32/h3-4,7-14,17H,2,5-6,15-16,18H2,1H3,(H,33,37)
InChIKey	LWBLXVVSJHCBLT-UHFFFAOYSA-N
Molecular Weight	600.613 g/mol
SMILES	N(C(CN1N=C(c2cc(S(N3CCCCC3)(=O)=O)c(cc2)C)c2c(C1=O)cccc2)=O)c1ccc(OC(F)(F)F)cc1
SPLASH	splash10-001m-9330000000-7f36657bd7f46a908322
Synonyms	2-[4-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-1-oxidanylidene-phthalazin-2-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide 2-[4-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-1-oxophthalazin-2-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide 2-[4-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-1-oxo-2-phthalazinyl]-N-[4-(trifluoromethoxy)phenyl]acetamide 2-[4-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-1-oxo-phthalazin-2-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Wiley ID	1464965