68866361 -OEChem-05082407002D 56 60 0 0 0 0 0 0 0999 V2000 5.4573 0.9600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4804 -1.0399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4902 3.5299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -4.1091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2924 4.1270 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9212 1.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6416 2.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 0.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5018 2.5300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -2.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9096 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7930 0.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7698 2.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6531 1.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3406 -0.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 0.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0726 -0.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3291 0.4701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2124 -1.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.5536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6744 4.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9724 5.0629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9724 5.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7205 1.9499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1111 2.6447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3692 2.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8001 -0.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7626 3.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1936 0.7163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1821 1.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6131 -0.8136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2196 -1.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 -2.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 -3.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0870 3.9099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6022 5.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3310 5.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -1.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -5.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -5.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 13 1 0 0 0 0 2 19 1 0 0 0 0 3 23 1 0 0 0 0 3 33 1 0 0 0 0 4 27 1 0 0 0 0 4 34 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 30 1 0 0 0 0 6 18 2 0 0 0 0 6 29 1 0 0 0 0 7 32 2 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 16 2 0 0 0 0 9 17 1 0 0 0 0 10 20 2 0 0 0 0 10 21 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 12 22 1 0 0 0 0 13 28 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 15 17 2 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 26 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 24 1 0 0 0 0 20 41 1 0 0 0 0 21 25 2 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 27 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 M END > 68866361 > 1 > 634 > 6 > 0 > 7 > AAADceB7MQAAAAAAAAAAAAAAAAAAAWAAAAA8YMEAAAAAAACx/AAAHwAIAAAADAzBng4+xvIIFACiAzRnRACSjCAxoiAY2CA+7JgNJuLE8duGvCrmyBnK6Afw8P8O4EABAgACQADAgAIEAASAAAAAAAAAAA== > 4-[2-fluoro-4-[4-(pyrazol-1-ylmethyl)phenyl]phenoxy]-6,7-dimethoxy-quinoline > 4-[2-fluoro-4-[4-(1-pyrazolylmethyl)phenyl]phenoxy]-6,7-dimethoxyquinoline > 4-[2-fluoro-4-[4-(pyrazol-1-ylmethyl)phenyl]phenoxy]-6,7-dimethoxyquinoline > 4-[2-fluoro-4-[4-(pyrazol-1-ylmethyl)phenyl]phenoxy]-6,7-dimethoxyquinoline > 4-[2-fluoranyl-4-[4-(pyrazol-1-ylmethyl)phenyl]phenoxy]-6,7-dimethoxy-quinoline > 4-[2-fluoro-4-[4-(pyrazol-1-ylmethyl)phenyl]phenoxy]-6,7-dimethoxy-quinoline > InChI=1S/C27H22FN3O3/c1-32-26-15-21-23(16-27(26)33-2)29-12-10-24(21)34-25-9-8-20(14-22(25)28)19-6-4-18(5-7-19)17-31-13-3-11-30-31/h3-16H,17H2,1-2H3 > JZZRQMYAZHDJPE-UHFFFAOYSA-N > 5.3 > 455.16451973 > C27H22FN3O3 > 455.5 > COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=C3)C4=CC=C(C=C4)CN5C=CC=N5)F > COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=C3)C4=CC=C(C=C4)CN5C=CC=N5)F > 58.4 > 455.16451973 > 0 > 34 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 20 8 10 21 8 12 13 8 12 18 8 12 22 8 13 28 8 14 16 8 15 17 8 18 26 8 19 24 8 19 25 8 20 24 8 21 25 8 22 23 8 23 27 8 26 27 8 28 29 8 30 31 8 31 32 8 5 30 8 5 7 8 6 18 8 6 29 8 7 32 8 8 14 8 8 15 8 9 16 8 9 17 8 $$$$