24892626 -OEChem-05032420302D 72 75 0 1 0 0 0 0 0999 V2000 6.9124 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.9338 7.1119 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0378 5.5170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4338 7.9779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4338 6.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3979 4.1119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0678 7.6119 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.2640 5.6119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9960 8.6119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 4.1232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0678 8.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2018 7.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2018 9.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3358 7.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3358 8.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7998 6.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 7.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 9.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 7.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 8.6327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7998 5.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6659 7.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 6.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5319 5.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 7.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6659 5.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5319 6.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3979 5.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 8.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 5.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7048 4.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2048 3.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9960 9.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8620 8.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7048 4.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7048 3.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2048 3.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7048 3.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2048 3.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6784 8.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2798 9.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 6.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6003 6.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6003 9.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 9.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 6.4572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 9.7665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.9448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2629 5.3019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6659 7.7319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0519 7.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6534 6.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3420 6.5293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7406 7.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6659 4.4919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 6.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9179 8.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5194 8.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6160 9.6119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9960 10.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3760 9.6119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5520 7.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3990 7.8019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1720 8.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0148 5.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3948 2.5110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0148 2.5110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2048 3.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8248 3.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2048 4.5339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9124 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 72 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 6 28 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 23 1 0 0 0 0 8 28 1 0 0 0 0 8 30 1 0 0 0 0 9 29 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 30 2 0 0 0 0 10 32 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 14 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 26 1 0 0 0 0 21 50 1 0 0 0 0 22 27 2 0 0 0 0 22 51 1 0 0 0 0 23 25 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 24 28 1 0 0 0 0 25 29 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 36 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 37 2 0 0 0 0 35 66 1 0 0 0 0 36 38 2 0 0 0 0 36 67 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 38 68 1 0 0 0 0 39 69 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 M END > 24892626 > 1 > 902 > 7 > 1 > 8 > AAADcfB7sABkAAAAAAAAAAAAAAAAAWAAAAA8YMEAAAAAAFix9AAAHgQAQAAADAjB3gQz0bMIEAqsAyVydHDD8LllCjhJmD04ZNiIILLg3ZGEIQhohwLIyacYiICOmAAAgAAQAQAwAAEAACACAAAAAAAAAA== > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride > InChI=1S/C29H32N4O3S2.ClH/c1-21-9-14-26-27(19-21)37-29(30-26)33(17-6-16-31(2)3)28(34)23-10-12-25(13-11-23)38(35,36)32-18-15-22-7-4-5-8-24(22)20-32;/h4-5,7-14,19H,6,15-18,20H2,1-3H3;1H > KCBOUHQOBPIIQM-UHFFFAOYSA-N > 584.1682610 > C29H33ClN4O3S2 > 585.2 > CC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4.Cl > CC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4.Cl > 110 > 584.1682610 > 0 > 39 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 10 30 8 10 32 8 14 15 8 14 17 8 15 18 8 16 21 8 16 22 8 17 19 8 18 20 8 19 20 8 21 26 8 22 27 8 24 26 8 24 27 8 3 30 8 3 31 8 31 32 8 31 35 8 32 36 8 35 37 8 36 38 8 37 38 8 $$$$