24894028 -OEChem-04252400092D 68 72 0 1 0 0 0 0 0999 V2000 6.5169 2.0281 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3127 -3.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5169 2.0281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5169 2.0281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0760 -2.7824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3115 -1.0868 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.5169 1.0281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3676 -1.6284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6452 -1.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0169 -0.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7079 0.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9896 -0.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6925 0.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9579 -2.7824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6663 -1.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0169 -0.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 0.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2916 -3.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3255 -1.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7019 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0128 -2.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6592 -0.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0339 -2.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6803 -0.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3414 0.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7224 -1.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3887 -1.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5169 3.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3044 -1.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6509 3.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4513 -1.2436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1056 -1.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8619 -1.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6104 0.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4414 -0.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9321 1.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 1.0065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3415 -3.2695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -2.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8963 -1.0526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1392 -1.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0616 -4.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8187 -3.8546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6164 -1.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4537 -2.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5194 -0.6312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5035 -1.8829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0321 -2.7896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6265 -2.2586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1863 -0.1478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4292 0.1014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5068 -2.7006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2639 -2.9498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6611 -0.0588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0667 -0.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5261 1.2644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1275 2.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 3.6107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6502 0.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4310 -1.6229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9114 -0.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1779 -0.4090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9609 4.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 3.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3409 2.9912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 30 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 5 29 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 29 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 19 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 20 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 27 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 32 1 0 0 0 0 21 49 1 0 0 0 0 22 28 2 0 0 0 0 22 50 1 0 0 0 0 23 25 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 26 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 31 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 30 33 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 M END > 24894028 > 1 > 801 > 5 > 0 > 4 > AAADcfB7OABAAAAAAAAAAAAAAAAAAWAAAAA8WJEAAAAAAFgB8AAAHgQAQAAADSjl3gaywPMIFAKoAyVyVHDCgCAlAiAImCE4ZNgIIPLA1ZGGIQhmhgDIyYeYicCeiAACAAACAAAQAAQAAAQAAAAAAAAAAA== > (5-ethylsulfonyl-2-tetrahydropyran-4-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-8-yl)-(4-methyl-1-piperidyl)methanone > [5-ethylsulfonyl-2-(4-oxanyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-8-yl]-(4-methyl-1-piperidinyl)methanone > [5-ethylsulfonyl-2-(oxan-4-yl)-3,4-dihydro-1H-pyrido[4,3-b]indol-8-yl]-(4-methylpiperidin-1-yl)methanone > [5-ethylsulfonyl-2-(oxan-4-yl)-3,4-dihydro-1H-pyrido[4,3-b]indol-8-yl]-(4-methylpiperidin-1-yl)methanone > [5-ethylsulfonyl-2-(oxan-4-yl)-3,4-dihydro-1H-pyrido[4,3-b]indol-8-yl]-(4-methylpiperidin-1-yl)methanone > (5-esyl-2-tetrahydropyran-4-yl-3,4-dihydro-1H-pyrid[4,3-b]indol-8-yl)-(4-methylpiperidino)methanone > InChI=1S/C25H35N3O4S/c1-3-33(30,31)28-23-5-4-19(25(29)26-11-6-18(2)7-12-26)16-21(23)22-17-27(13-8-24(22)28)20-9-14-32-15-10-20/h4-5,16,18,20H,3,6-15,17H2,1-2H3 > UCMNIYFDRVBMFV-UHFFFAOYSA-N > 3.1 > 473.23482778 > C25H35N3O4S > 473.6 > CCS(=O)(=O)N1C2=C(CN(CC2)C3CCOCC3)C4=C1C=CC(=C4)C(=O)N5CCC(CC5)C > CCS(=O)(=O)N1C2=C(CN(CC2)C3CCOCC3)C4=C1C=CC(=C4)C(=O)N5CCC(CC5)C > 80.2 > 473.23482778 > 0 > 33 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 12 8 11 17 8 17 18 8 17 22 8 18 27 8 22 28 8 27 31 8 28 31 8 7 12 8 7 18 8 $$$$