71060621 -OEChem-04192421072D 84 88 0 1 0 0 0 0 0999 V2000 7.4717 5.4711 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.3988 -0.9022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -1.7402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -0.8742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6588 0.3578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -0.0082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -0.0082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3179 -3.6811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 1.7238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 0.8578 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7078 1.6668 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6200 1.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6200 -0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6588 1.3578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7078 0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 1.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 0.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3988 2.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4679 -0.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -0.8742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.8742 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0679 3.3610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4206 2.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3814 0.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3633 -1.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -1.7402 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7589 4.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1116 3.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7807 4.5200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -1.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7149 -3.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1087 -2.7093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 0.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4592 -4.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7644 -3.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 0.3578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 1.3578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -5.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5582 -4.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3024 -5.4711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1462 2.1052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2026 1.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5123 2.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5123 -0.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2026 -0.2202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2754 1.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7878 1.9643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7277 2.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0374 1.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 1.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 0.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9015 -0.4821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.8742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6744 3.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0058 2.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6336 -0.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9478 0.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1292 0.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7467 -1.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2985 -1.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9799 -1.2893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -2.2772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1737 4.7728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5052 3.9058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 0.5287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -1.1202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -2.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5228 -2.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8852 -3.9314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3029 -3.4107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 0.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 0.0478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 0.8209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 -5.5745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 2.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9688 -4.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1746 -6.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 15 2 0 0 0 0 3 20 2 0 0 0 0 4 32 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 19 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 20 1 0 0 0 0 21 7 1 1 0 0 0 7 32 1 0 0 0 0 7 67 1 0 0 0 0 8 34 1 0 0 0 0 8 36 1 0 0 0 0 8 72 1 0 0 0 0 9 35 1 0 0 0 0 9 81 1 0 0 0 0 9 82 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 15 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 11 43 1 0 0 0 0 12 16 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 21 26 1 0 0 0 0 21 55 1 0 0 0 0 22 27 1 0 0 0 0 22 56 1 0 0 0 0 23 28 2 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 29 1 0 0 0 0 26 31 1 0 0 0 0 26 64 1 0 0 0 0 27 30 2 0 0 0 0 27 65 1 0 0 0 0 28 30 1 0 0 0 0 28 66 1 0 0 0 0 29 33 1 0 0 0 0 29 34 2 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 35 1 0 0 0 0 33 36 1 0 0 0 0 33 37 2 0 0 0 0 34 71 1 0 0 0 0 35 38 1 0 0 0 0 35 39 1 0 0 0 0 36 40 2 0 0 0 0 37 41 1 0 0 0 0 37 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 39 79 1 0 0 0 0 40 42 1 0 0 0 0 40 80 1 0 0 0 0 41 42 2 0 0 0 0 41 83 1 0 0 0 0 42 84 1 0 0 0 0 M END > 71060621 > 1 > 1010 > 5 > 3 > 7 > AAADcfB/sQAAAAAAAAAAAAAAAAAAAWLAAAA8YIAAAAAAAFgB9AAAHwAQAAAAD6jBngw+wPPJkACoAzV3VACCgCAxAiAI2aG4ZJgIYPrA0bGUIAhglgDIyAccicCPgAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > 2-amino-N-[(1R)-1-[4-(4-fluorophenyl)-2-isopropyl-1-oxo-2,9-diazaspiro[4.5]decane-9-carbonyl]-2-(1H-indol-3-yl)propyl]-2-methyl-propanamide > 2-amino-N-[(2R)-1-[4-(4-fluorophenyl)-1-oxo-2-propan-2-yl-2,9-diazaspiro[4.5]decan-9-yl]-3-(1H-indol-3-yl)-1-oxobutan-2-yl]-2-methylpropanamide > 2-amino-N-[(2R)-1-[4-(4-fluorophenyl)-1-oxo-2-propan-2-yl-2,9-diazaspiro[4.5]decan-9-yl]-3-(1H-indol-3-yl)-1-oxobutan-2-yl]-2-methylpropanamide > 2-amino-N-[(2R)-1-[4-(4-fluorophenyl)-1-oxo-2-propan-2-yl-2,9-diazaspiro[4.5]decan-9-yl]-3-(1H-indol-3-yl)-1-oxobutan-2-yl]-2-methylpropanamide > 2-azanyl-N-[(2R)-1-[4-(4-fluorophenyl)-1-oxidanylidene-2-propan-2-yl-2,9-diazaspiro[4.5]decan-9-yl]-3-(1H-indol-3-yl)-1-oxidanylidene-butan-2-yl]-2-methyl-propanamide > 2-amino-N-[(1R)-1-[4-(4-fluorophenyl)-2-isopropyl-1-keto-2,9-diazaspiro[4.5]decane-9-carbonyl]-2-(1H-indol-3-yl)propyl]-2-methyl-propionamide > InChI=1S/C33H42FN5O3/c1-20(2)39-18-26(22-11-13-23(34)14-12-22)33(31(39)42)15-8-16-38(19-33)29(40)28(37-30(41)32(4,5)35)21(3)25-17-36-27-10-7-6-9-24(25)27/h6-7,9-14,17,20-21,26,28,36H,8,15-16,18-19,35H2,1-5H3,(H,37,41)/t21?,26?,28-,33?/m1/s1 > VCSPWLVUCHQYCW-QXDRMZDASA-N > 3.4 > 575.32716838 > C33H42FN5O3 > 575.7 > CC(C)N1CC(C2(C1=O)CCCN(C2)C(=O)C(C(C)C3=CNC4=CC=CC=C43)NC(=O)C(C)(C)N)C5=CC=C(C=C5)F > CC(C)N1CC(C2(C1=O)CCCN(C2)C(=O)[C@@H](C(C)C3=CNC4=CC=CC=C43)NC(=O)C(C)(C)N)C5=CC=C(C=C5)F > 112 > 575.32716838 > 0 > 42 > 1 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 3 11 18 3 18 22 8 18 23 8 22 27 8 23 28 8 26 31 3 27 30 8 28 30 8 29 33 8 29 34 8 33 36 8 33 37 8 36 40 8 37 41 8 40 42 8 41 42 8 21 7 5 8 34 8 8 36 8 $$$$