70335576 -OEChem-03192407462D 69 71 0 1 0 0 0 0 0999 V2000 8.9282 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 3.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1962 0.5179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 1.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6962 1.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6962 -0.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 0.5179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1962 -1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6962 -0.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 -1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5062 1.0549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1135 1.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8038 0.7734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2788 1.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5885 1.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2212 0.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2212 -0.7466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7788 0.7300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0885 1.1285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6135 -1.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3038 -1.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1711 -0.7466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1711 0.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0885 -1.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7788 -1.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0762 3.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0062 3.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -2.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 3.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 4.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 11 2 1 1 0 0 0 2 23 1 0 0 0 0 2 57 1 0 0 0 0 8 3 1 6 0 0 0 3 58 1 0 0 0 0 3 59 1 0 0 0 0 4 22 1 0 0 0 0 4 25 1 0 0 0 0 4 62 1 0 0 0 0 5 27 1 0 0 0 0 5 29 2 0 0 0 0 6 7 1 1 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 13 1 0 0 0 0 8 22 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 14 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 15 1 0 0 0 0 11 37 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 18 50 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 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 26 1 0 0 0 0 24 27 2 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 28 2 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 28 29 1 0 0 0 0 28 68 1 0 0 0 0 29 69 1 0 0 0 0 M END > 70335576 > 1 > 493 > 4 > 3 > 9 > AAADcfB7oAAAAAAAAAAAAAAAAAAAAAAAAAA8YIAAAAAAAAABgAAAHgAQAAAADajBmgQ+gJLIEACoAjF3VACCgCAxAiAI2KG4ZJgIYPLA0ZGUIAhgkgDIyAcYiMCOAAAAAAAAAAAAAACAAAAAAAAAAAAAAA== > (2R)-2-amino-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(3-pyridylmethylamino)cyclohexyl]methyl]butanamide > (2R)-2-amino-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(3-pyridinylmethylamino)cyclohexyl]methyl]butanamide > (2R)-2-amino-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(pyridin-3-ylmethylamino)cyclohexyl]methyl]butanamide > (2R)-2-amino-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(pyridin-3-ylmethylamino)cyclohexyl]methyl]butanamide > (2R)-2-azanyl-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(pyridin-3-ylmethylamino)cyclohexyl]methyl]butanamide > (2R)-2-amino-4-cyclohexyl-N-methyl-2-[[(1S,3R)-3-(3-pyridylmethylamino)cyclohexyl]methyl]butyramide > InChI=1S/C24H40N4O/c1-26-23(29)24(25,13-12-19-7-3-2-4-8-19)16-20-9-5-11-22(15-20)28-18-21-10-6-14-27-17-21/h6,10,14,17,19-20,22,28H,2-5,7-9,11-13,15-16,18,25H2,1H3,(H,26,29)/t20-,22+,24+/m0/s1 > ASGYZEQYZSLUMM-BGWNEDDSSA-N > 4 > 400.32021191 > C24H40N4O > 400.6 > CNC(=O)C(CCC1CCCCC1)(CC2CCCC(C2)NCC3=CN=CC=C3)N > CNC(=O)[C@@](CCC1CCCCC1)(C[C@H]2CCC[C@H](C2)NCC3=CN=CC=C3)N > 80 > 400.32021191 > 0 > 29 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 2 5 24 26 8 24 27 8 26 28 8 28 29 8 8 3 6 5 27 8 5 29 8 6 7 5 $$$$