24892694 -OEChem-05092413162D 68 70 0 0 0 0 0 0 0999 V2000 6.2115 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 4.1806 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5443 4.2419 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.0466 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.0466 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 3.1806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 5.1806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1279 3.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 4.1806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1279 5.0466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1279 8.5107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5443 5.8513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0618 3.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0618 5.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0367 3.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0367 5.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8185 3.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8185 4.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 4.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 5.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 3.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6279 4.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 5.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 3.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6279 5.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1279 6.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6279 4.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6279 7.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1279 5.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6279 9.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1279 8.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 4.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 4.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4573 3.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0618 2.6596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0618 5.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4573 5.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7677 2.4985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5215 2.6705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5215 5.6906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7677 5.8627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0876 3.1220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4230 3.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4230 4.5426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0876 5.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4379 5.5835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4379 2.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8179 5.5835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8179 2.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1028 5.5141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1028 6.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 7.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 6.3801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1028 7.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1028 8.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 9.0667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9379 9.9137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 9.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1279 9.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5079 8.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1279 7.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3291 5.8566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2115 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 68 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 9 1 0 0 0 0 2 19 1 0 0 0 0 3 29 1 0 0 0 0 3 32 1 0 0 0 0 4 34 1 0 0 0 0 5 36 1 0 0 0 0 8 27 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 25 1 0 0 0 0 10 27 1 0 0 0 0 10 29 1 0 0 0 0 11 28 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 29 2 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 50 1 0 0 0 0 21 24 2 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 28 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 32 35 2 0 0 0 0 33 34 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 66 1 0 0 0 0 36 37 2 0 0 0 0 37 67 1 0 0 0 0 M END > 24892694 > 1 > 828 > 9 > 1 > 8 > AAADceB7sYBkAAAAAAAAAAAAAAAAAWAAAAAwYAAABYAAAFgB9AAAHwQAQAAADAjB3gwz0bMIEAqsAyVydHDD8LllCDhJmD0oRNiIILLg3ZGEIQhohwLIyacYiACOEAAAAAAAAQAgAAAAAAACAAAAAAAAAA== > 4-(azepan-1-ylsulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > 4-(1-azepanylsulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > 4-(azepan-1-ylsulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > 4-(azepan-1-ylsulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > 4-(azepan-1-ylsulfonyl)-N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > 4-(azepan-1-ylsulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide;hydrochloride > InChI=1S/C25H30F2N4O3S2.ClH/c1-29(2)12-7-15-31(25-28-23-21(27)16-19(26)17-22(23)35-25)24(32)18-8-10-20(11-9-18)36(33,34)30-13-5-3-4-6-14-30;/h8-11,16-17H,3-7,12-15H2,1-2H3;1H > BPFGNAQSCUUSSI-UHFFFAOYSA-N > 572.1494172 > C25H31ClF2N4O3S2 > 573.1 > CN(C)CCCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4.Cl > CN(C)CCCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4.Cl > 110 > 572.1494172 > 0 > 37 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 12 29 8 12 33 8 19 20 8 19 21 8 20 23 8 21 24 8 22 23 8 22 24 8 3 29 8 3 32 8 32 33 8 32 35 8 33 34 8 34 37 8 35 36 8 36 37 8 $$$$