53465710 -OEChem-03282412312D 59 61 0 0 0 0 0 0 0999 V2000 10.6603 -0.2306 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6603 -0.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6602 -0.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.2306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8512 -1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4693 -1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1603 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1603 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.1354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5412 -1.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2848 -2.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0357 -2.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7793 -1.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5538 -2.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2251 -3.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0954 -3.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7667 -2.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 0.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 0.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -1.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 0.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 -0.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -1.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -2.1335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 2.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 5 50 1 0 0 0 0 6 13 1 0 0 0 0 6 27 2 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 18 2 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 20 1 0 0 0 0 18 22 1 0 0 0 0 19 21 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 25 2 0 0 0 0 21 26 1 0 0 0 0 22 28 2 0 0 0 0 22 53 1 0 0 0 0 23 25 1 0 0 0 0 23 54 1 0 0 0 0 24 26 2 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 M END > 53465710 > 1 > 568 > 5 > 1 > 8 > AAADceB7MABAAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAAABwAAAHAQQQAAADgDBWgQ+gZLIEAKgAjBnRHDK0DAxAiAI2LA4ZJgIIOLAkZGEIAhgkADIyAcQgMAPwAAAAAAAAACAAAAAAAAAAAAAAAAAAA== > 3,3-dimethyl-N-[[4-(2-pyrrolidin-1-ylsulfonyl-3-pyridyl)phenyl]methyl]butan-1-amine > 3,3-dimethyl-N-[[4-[2-(1-pyrrolidinylsulfonyl)-3-pyridinyl]phenyl]methyl]-1-butanamine > 3,3-dimethyl-N-[[4-(2-pyrrolidin-1-ylsulfonylpyridin-3-yl)phenyl]methyl]butan-1-amine > 3,3-dimethyl-N-[[4-(2-pyrrolidin-1-ylsulfonylpyridin-3-yl)phenyl]methyl]butan-1-amine > 3,3-dimethyl-N-[[4-(2-pyrrolidin-1-ylsulfonylpyridin-3-yl)phenyl]methyl]butan-1-amine > 3,3-dimethylbutyl-[4-(2-pyrrolidinosulfonyl-3-pyridyl)benzyl]amine > InChI=1S/C22H31N3O2S/c1-22(2,3)12-14-23-17-18-8-10-19(11-9-18)20-7-6-13-24-21(20)28(26,27)25-15-4-5-16-25/h6-11,13,23H,4-5,12,14-17H2,1-3H3 > OZDYNHVVZWVNHC-UHFFFAOYSA-N > 3.9 > 401.21369841 > C22H31N3O2S > 401.6 > CC(C)(C)CCNCC1=CC=C(C=C1)C2=C(N=CC=C2)S(=O)(=O)N3CCCC3 > CC(C)(C)CCNCC1=CC=C(C=C1)C2=C(N=CC=C2)S(=O)(=O)N3CCCC3 > 70.7 > 401.21369841 > 0 > 28 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 18 8 18 22 8 20 23 8 20 24 8 21 25 8 21 26 8 22 28 8 23 25 8 24 26 8 27 28 8 6 13 8 6 27 8 $$$$