70688075 -OEChem-05092408252D 60 62 0 1 0 0 0 0 0999 V2000 5.7970 0.4348 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5238 -1.2208 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7147 -6.8086 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7147 -5.8086 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7147 -5.8086 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1482 3.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9225 6.3070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3238 5.2889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9057 -1.2208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8025 0.5393 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3958 1.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 1.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 -0.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2147 -0.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7147 -1.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3848 1.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 0.5393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7147 -2.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3794 1.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 2.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9671 1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5604 2.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5659 2.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5808 -3.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8487 -3.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7147 -4.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5808 -4.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8487 -4.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9616 1.8438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7147 -5.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7414 4.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3292 5.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1669 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9974 1.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3525 2.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7997 1.4074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4445 0.9389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5961 2.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9513 3.0894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 3.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.6403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1285 0.9037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1254 0.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6315 0.5729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3615 2.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3137 3.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 -2.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3118 -2.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 -4.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3118 -4.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8968 1.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5783 1.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0265 2.4604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3108 5.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2274 4.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2869 6.8086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 32 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 24 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 60 1 0 0 0 0 8 34 2 0 0 0 0 9 15 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 2 0 0 0 0 14 17 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 26 2 0 0 0 0 20 27 1 0 0 0 0 21 23 1 0 0 0 0 21 48 1 0 0 0 0 22 25 2 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 31 1 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 26 29 1 0 0 0 0 26 51 1 0 0 0 0 27 30 2 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END > 70688075 > 1 > 645 > 9 > 1 > 10 > AAADceB6MYBgAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAAAB0AAAHwQACAAADAyl3hKyj5IIFgisAyTyTAKC+KBhKDgImDx2TJgNJqLksR+GOCjkwBHr6AeQwKAOQIAAgAAIAACBAAEAABAAAAAAAAAAAA== > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]pentylsulfanyl]phenoxy]acetic acid > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]pentylthio]phenoxy]acetic acid > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentylsulfanyl]phenoxy]acetic acid > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentylsulfanyl]phenoxy]acetic acid > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentylsulfanyl]phenoxy]ethanoic acid > 2-[2-methyl-4-[1-[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]pentylthio]phenoxy]acetic acid > InChI=1S/C25H26F3NO3S2/c1-4-5-6-21(33-19-11-12-20(15(2)13-19)32-14-22(30)31)23-16(3)29-24(34-23)17-7-9-18(10-8-17)25(26,27)28/h7-13,21H,4-6,14H2,1-3H3,(H,30,31) > JYVHKHHKUPLYOZ-UHFFFAOYSA-N > 7.7 > 509.13062052 > C25H26F3NO3S2 > 509.6 > CCCCC(C1=C(N=C(S1)C2=CC=C(C=C2)C(F)(F)F)C)SC3=CC(=C(C=C3)OCC(=O)O)C > CCCCC(C1=C(N=C(S1)C2=CC=C(C=C2)C(F)(F)F)C)SC3=CC(=C(C=C3)OCC(=O)O)C > 113 > 509.13062052 > 0 > 34 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 3 13 15 8 18 21 8 18 22 8 2 13 8 2 16 8 20 26 8 20 27 8 21 23 8 22 25 8 23 24 8 24 25 8 26 29 8 27 30 8 28 29 8 28 30 8 9 15 8 9 16 8 $$$$