22124497 -OEChem-05052400342D 81 86 0 1 0 0 0 0 0999 V2000 7.2382 -0.6163 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2034 -1.6157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2732 0.3831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8816 1.1846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5657 1.5319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2389 -0.5814 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 5.7389 -4.1203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9381 2.1243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6021 2.6275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6069 4.1774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7389 -2.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5479 -1.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9298 -1.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8728 -2.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6049 -2.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2389 -0.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8728 -3.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6049 -3.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2389 0.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9144 -1.7647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5539 0.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5961 1.1846 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2376 -0.6512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2115 -0.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5334 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6113 1.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7071 -1.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7676 0.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9685 1.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9229 2.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7065 -1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7670 0.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2098 2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2649 3.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9769 1.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2364 -0.7210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3608 3.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2046 2.8956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3252 3.5797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0919 3.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 4.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1251 4.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2761 4.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8579 -2.0694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1143 -1.2803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 -2.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2622 -2.7279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2155 -2.7279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8169 -2.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2622 -3.5126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 -4.2029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8169 -4.2029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2155 -3.5126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7389 -4.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7297 -2.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7523 0.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2066 1.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6056 -1.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1203 0.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0744 0.7011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8233 0.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5396 2.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3786 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4765 0.7443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9976 -2.1165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0955 0.6877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6492 1.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8560 -0.7427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9926 2.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7872 2.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4167 3.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5373 4.1623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7426 3.7917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1132 2.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6183 2.8847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2175 4.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2084 4.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8676 4.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 4.5038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2967 5.3599 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 6 1 0 0 0 0 1 23 1 0 0 0 0 4 19 2 0 0 0 0 5 30 2 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 6 19 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 54 1 0 0 0 0 8 22 1 0 0 0 0 8 30 1 0 0 0 0 8 62 1 0 0 0 0 9 35 1 0 0 0 0 9 37 1 0 0 0 0 9 69 1 0 0 0 0 10 34 1 0 0 0 0 10 77 1 0 0 0 0 10 78 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 16 1 0 0 0 0 13 20 2 0 0 0 0 14 17 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 18 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 21 2 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 22 1 0 0 0 0 20 24 1 0 0 0 0 20 55 1 0 0 0 0 21 25 1 0 0 0 0 21 56 1 0 0 0 0 22 26 1 0 0 0 0 22 57 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 26 29 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 31 1 0 0 0 0 27 63 1 0 0 0 0 28 32 2 0 0 0 0 28 64 1 0 0 0 0 29 33 1 0 0 0 0 29 35 2 0 0 0 0 30 34 1 0 0 0 0 31 36 2 0 0 0 0 31 65 1 0 0 0 0 32 36 1 0 0 0 0 32 66 1 0 0 0 0 33 37 1 0 0 0 0 33 40 2 0 0 0 0 34 38 1 0 0 0 0 34 39 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 37 41 2 0 0 0 0 38 70 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 40 42 1 0 0 0 0 40 76 1 0 0 0 0 41 43 1 0 0 0 0 41 79 1 0 0 0 0 42 43 2 0 0 0 0 42 80 1 0 0 0 0 43 81 1 0 0 0 0 M CHG 1 6 1 M END > 22124497 > 1 > 1140 > 6 > 4 > 7 > AAADcfB/uABAAAAAAAAAAAAAAAAAAWLAAAA8YMEAAAAAAFgB9AAAHgQQQAAADqjB3gQ+wfPJkAKoAzV3VHDCgDAxAiAI2bm4ZJgIYPLAkbGUIAhglgDIyAcYicCPgAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > 2-amino-N-[2-[1-(benzenesulfonyl)spiro[indolin-1-ium-3,4'-piperidine]-1-yl]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-methyl-propanamide > 2-amino-N-[1-[1-(benzenesulfonyl)-1-spiro[2H-indol-1-ium-3,4'-piperidine]yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide > 2-amino-N-[1-[1-(benzenesulfonyl)spiro[2H-indol-1-ium-3,4'-piperidine]-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide > 2-amino-N-[1-[1-(benzenesulfonyl)spiro[2H-indol-1-ium-3,4'-piperidine]-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide > 2-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[1-(phenylsulfonyl)spiro[2H-indol-1-ium-3,4'-piperidine]-1-yl]propan-2-yl]-2-methyl-propanamide > 2-amino-N-[2-(1-besylspiro[indolin-1-ium-3,4'-piperidine]-1-yl)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-methyl-propionamide > InChI=1S/C33H37N5O4S/c1-32(2,34)31(40)37-28(20-23-21-36-27-14-8-6-12-25(23)27)30(39)38(43(41,42)24-10-4-3-5-11-24)22-33(16-18-35-19-17-33)26-13-7-9-15-29(26)38/h3-15,21,28,35-36H,16-20,22,34H2,1-2H3/p+1 > OVHQYCKSCVLJCG-UHFFFAOYSA-O > 3.8 > 600.26445088 > C33H38N5O4S+ > 600.8 > CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)[N+]3(CC4(CCNCC4)C5=CC=CC=C53)S(=O)(=O)C6=CC=CC=C6)N > CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)[N+]3(CC4(CCNCC4)C5=CC=CC=C53)S(=O)(=O)C6=CC=CC=C6)N > 143 > 600.26445088 > 1 > 43 > 0 > 2 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 16 8 13 20 8 16 21 8 20 24 8 21 25 8 22 26 3 23 27 8 23 28 8 24 25 8 27 31 8 28 32 8 29 33 8 29 35 8 31 36 8 32 36 8 33 37 8 33 40 8 37 41 8 40 42 8 41 43 8 42 43 8 6 19 3 9 35 8 9 37 8 $$$$