68297441 -OEChem-05082415452D 76 81 0 1 0 0 0 0 0999 V2000 4.6783 4.5055 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3497 0.1796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 1.1027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.6294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7097 -4.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7458 -1.4915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5368 -3.4805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 1.9687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3007 -0.1294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.8960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 -0.6294 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.3497 -1.4384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3007 -1.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1097 -1.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 0.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 0.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0233 -1.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0052 -2.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8142 -3.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8323 -1.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7278 -2.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 1.9687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 2.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 3.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 2.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7962 -4.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8504 -0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 3.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4503 -3.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 3.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 4.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 4.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4804 -0.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8127 -1.7484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6018 -2.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5719 0.7736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5719 -2.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0881 -0.6938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4388 -2.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9519 -2.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 0.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 0.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8445 2.1807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 2.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7249 -1.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9519 -2.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7988 -1.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 2.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5440 -4.1343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2298 -4.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0483 -5.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4670 -0.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9152 0.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2338 -0.4322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7025 -3.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0167 -2.8216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1982 -2.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 3.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 5.1037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 5.1037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 34 1 0 0 0 0 1 38 1 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 18 1 0 0 0 0 3 26 1 0 0 0 0 4 22 1 0 0 0 0 4 29 1 0 0 0 0 5 23 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 25 1 0 0 0 0 7 35 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 14 2 0 0 0 0 10 34 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 17 21 2 0 0 0 0 17 49 1 0 0 0 0 18 22 2 0 0 0 0 19 24 1 0 0 0 0 19 50 1 0 0 0 0 20 23 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 23 25 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 31 1 0 0 0 0 28 36 2 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 30 37 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 40 1 0 0 0 0 36 70 1 0 0 0 0 37 40 2 0 0 0 0 37 71 1 0 0 0 0 38 39 1 0 0 0 0 38 41 2 0 0 0 0 39 42 2 0 0 0 0 40 72 1 0 0 0 0 41 43 1 0 0 0 0 41 73 1 0 0 0 0 42 44 1 0 0 0 0 42 74 1 0 0 0 0 43 44 2 0 0 0 0 43 75 1 0 0 0 0 44 76 1 0 0 0 0 M END > 68297441 > 1 > 914 > 10 > 0 > 12 > AAADcfB/OABAAAAAAAAAAAAAAAAAAWIAAAAwYMGAAAAAAFgB9AAAHgQEAAAADByh3gIyx7IYFAikAyRiRACD+KBhKjhImDw27JgNJ6LksZuGOCrlwBXq6Afw4PwOIAABCAAAQQBAAAIQAACCAAAAAAAAAA== > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxy-phenyl]-3-(3,4,5-trimethoxyphenyl)-4,5-dihydroisoxazole > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxyphenyl]-3-(3,4,5-trimethoxyphenyl)-4,5-dihydroisoxazole > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxyphenyl]-3-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxyphenyl]-3-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxy-phenyl]-3-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole > 5-[3-[2-[3-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]-4-methoxy-phenyl]-3-(3,4,5-trimethoxyphenyl)-2-isoxazoline > InChI=1S/C34H32N2O7S/c1-37-27-13-12-21(28-20-26(36-43-28)23-18-30(38-2)33(40-4)31(19-23)39-3)17-29(27)42-15-14-41-24-9-7-8-22(16-24)34-35-25-10-5-6-11-32(25)44-34/h5-13,16-19,28H,14-15,20H2,1-4H3 > PJKNLGGBAIDQMR-UHFFFAOYSA-N > 7 > 612.19302254 > C34H32N2O7S > 612.7 > COC1=C(C=C(C=C1)C2CC(=NO2)C3=CC(=C(C(=C3)OC)OC)OC)OCCOC4=CC=CC(=C4)C5=NC6=CC=CC=C6S5 > COC1=C(C=C(C=C1)C2CC(=NO2)C3=CC(=C(C(=C3)OC)OC)OC)OCCOC4=CC=CC(=C4)C5=NC6=CC=CC=C6S5 > 118 > 612.19302254 > 0 > 44 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 34 8 1 38 8 10 34 8 10 39 8 11 13 3 13 16 8 13 17 8 15 19 8 15 20 8 16 18 8 17 21 8 18 22 8 19 24 8 20 23 8 21 22 8 23 25 8 24 25 8 28 31 8 28 36 8 30 31 8 30 37 8 36 40 8 37 40 8 38 39 8 38 41 8 39 42 8 41 43 8 42 44 8 43 44 8 $$$$