68297621 -OEChem-04262417052D 82 86 0 0 0 0 0 0 0999 V2000 4.6783 3.4028 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 4.3301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 -5.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -3.4641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 -5.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.7933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 -3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 -4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 -3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2619 -4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3445 1.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6793 0.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3695 0.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 1.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8445 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1542 1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 1.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 4.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9519 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 1.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3819 -0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5719 1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4519 -2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0719 -1.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5719 -2.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1419 -3.4641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.2181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.4081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2988 5.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 5.7331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2249 4.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7988 2.2881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5719 3.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7249 2.9081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -4.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1419 -5.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -5.8162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7988 -2.9081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5719 -2.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7249 -2.2881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -5.8162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3819 -5.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -4.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 27 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 13 1 0 0 0 0 3 15 1 0 0 0 0 4 17 1 0 0 0 0 4 41 1 0 0 0 0 5 23 1 0 0 0 0 5 42 1 0 0 0 0 6 36 1 0 0 0 0 6 43 1 0 0 0 0 7 37 1 0 0 0 0 7 44 1 0 0 0 0 8 38 1 0 0 0 0 8 45 1 0 0 0 0 9 24 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 13 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 20 1 0 0 0 0 15 23 2 0 0 0 0 16 19 2 0 0 0 0 16 22 1 0 0 0 0 16 24 1 0 0 0 0 17 19 1 0 0 0 0 18 22 2 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 25 1 0 0 0 0 21 29 1 0 0 0 0 22 57 1 0 0 0 0 23 26 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 33 2 0 0 0 0 29 31 2 3 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 34 2 0 0 0 0 30 35 1 0 0 0 0 31 61 1 0 0 0 0 32 39 1 0 0 0 0 32 64 1 0 0 0 0 33 40 1 0 0 0 0 33 65 1 0 0 0 0 34 37 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 38 1 0 0 0 0 37 38 2 0 0 0 0 39 40 2 0 0 0 0 39 66 1 0 0 0 0 40 67 1 0 0 0 0 41 68 1 0 0 0 0 41 69 1 0 0 0 0 41 70 1 0 0 0 0 42 71 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 43 74 1 0 0 0 0 43 75 1 0 0 0 0 43 76 1 0 0 0 0 44 77 1 0 0 0 0 44 78 1 0 0 0 0 44 79 1 0 0 0 0 45 80 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 M END > 68297621 > 1 > 866 > 9 > 0 > 15 > AAADcfB+OABAAAAAAAAAAAAAAAAAAWAAAAAwYMGAAAAAAFgB9AAAHgQAAAAADAyh3gIyx7IIFAikAyRiRACD+KBhKjhImDw27JgNJ6LksZuGOCrlwBXq6Afw8B4OIAABCAAAQQBAAAIQAACCAAAAAAAAAA== > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)vinyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[4-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)vinyl]phenoxy]butoxy]phenyl]-1,3-benzothiazole > InChI=1S/C36H37NO7S/c1-38-28-16-14-24(12-13-25-21-32(40-3)35(42-5)33(22-25)41-4)20-31(28)44-19-9-8-18-43-29-17-15-26(23-30(29)39-2)36-37-27-10-6-7-11-34(27)45-36/h6-7,10-17,20-23H,8-9,18-19H2,1-5H3 > CUHBTEKYROKNPC-UHFFFAOYSA-N > 8.5 > 627.22907369 > C36H37NO7S > 627.7 > COC1=C(C=C(C=C1)C=CC2=CC(=C(C(=C2)OC)OC)OC)OCCCCOC3=C(C=C(C=C3)C4=NC5=CC=CC=C5S4)OC > COC1=C(C=C(C=C1)C=CC2=CC(=C(C(=C2)OC)OC)OC)OCCCCOC3=C(C=C(C=C3)C4=NC5=CC=CC=C5S4)OC > 106 > 627.22907369 > 0 > 45 > 0 > 0 > 0 > 1 > 0 > 1 > -1 > 1 5 255 > 1 24 8 1 27 8 14 17 8 14 18 8 15 20 8 15 23 8 16 19 8 16 22 8 17 19 8 18 22 8 20 21 8 21 25 8 23 26 8 25 26 8 27 28 8 27 32 8 28 33 8 29 31 1 30 34 8 30 35 8 32 39 8 33 40 8 34 37 8 35 36 8 36 38 8 37 38 8 39 40 8 9 24 8 9 28 8 $$$$