65799 -OEChem-04262416182D 84 87 0 0 0 0 0 0 0999 V2000 7.1962 0.9807 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 0.4807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 0.1147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 1.8468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.4807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8026 -2.3240 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3862 -1.5193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -2.5193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.0193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 2.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8026 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 3.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 1.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1133 -3.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1133 0.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0918 -3.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 1.9557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 1.9557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 0.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.5634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 0.8731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -0.9942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -0.9942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 0.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1855 2.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6444 2.5633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2458 1.8731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0685 0.3981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4670 1.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -0.8293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -1.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -1.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3424 3.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 4.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1024 3.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2785 1.4438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1254 1.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8985 2.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 -0.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 -0.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4995 -3.3619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0927 -3.8942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5874 -2.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7026 0.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3059 0.8253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5240 0.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9639 -4.0874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6985 -3.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2197 -2.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 20 1 0 0 0 0 2 19 2 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 6 40 2 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 7 54 1 0 0 0 0 8 19 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 38 1 0 0 0 0 10 28 2 0 0 0 0 11 26 2 0 0 0 0 11 39 1 0 0 0 0 12 35 1 0 0 0 0 12 40 1 0 0 0 0 12 78 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 14 16 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 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 20 29 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 56 1 0 0 0 0 22 25 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 23 28 1 0 0 0 0 24 27 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 27 39 2 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 29 36 1 0 0 0 0 29 61 1 0 0 0 0 30 37 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 31 37 1 0 0 0 0 32 35 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 37 74 1 0 0 0 0 38 42 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 41 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 42 82 1 0 0 0 0 42 83 1 0 0 0 0 42 84 1 0 0 0 0 M END > 65799 > 1 > 977 > 7 > 3 > 12 > AAADcfB7uABAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgB/AAAHgQYQAAADSzh3wY/t97IFAKqAzd3dHDSjDs1oKAd2Lk8TNiMLn7E/duGvejuvhrI6ecYiYAeEAAAAAAAAAAgAAAAAAAAAAAAAAAAAA== > N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-ethyl-4-isopentyloxy-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide > N-[2-[4-[[(cyclohexylamino)-oxomethyl]sulfamoyl]phenyl]ethyl]-1-ethyl-3-methyl-4-(3-methylbutoxy)-5-pyrazolo[3,4-b]pyridinecarboxamide > N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-ethyl-3-methyl-4-(3-methylbutoxy)pyrazolo[3,4-b]pyridine-5-carboxamide > N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-ethyl-3-methyl-4-(3-methylbutoxy)pyrazolo[3,4-b]pyridine-5-carboxamide > N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-ethyl-3-methyl-4-(3-methylbutoxy)pyrazolo[3,4-b]pyridine-5-carboxamide > N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-ethyl-4-isoamoxy-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide > InChI=1S/C30H42N6O5S/c1-5-36-28-26(21(4)34-36)27(41-18-16-20(2)3)25(19-32-28)29(37)31-17-15-22-11-13-24(14-12-22)42(39,40)35-30(38)33-23-9-7-6-8-10-23/h11-14,19-20,23H,5-10,15-18H2,1-4H3,(H,31,37)(H2,33,35,38) > DIBGLVNSPMMGHO-UHFFFAOYSA-N > 5.4 > 598.29373964 > C30H42N6O5S > 598.8 > CCN1C2=NC=C(C(=C2C(=N1)C)OCCC(C)C)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NC4CCCCC4 > CCN1C2=NC=C(C(=C2C(=N1)C)OCCC(C)C)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NC4CCCCC4 > 153 > 598.29373964 > 0 > 42 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 28 8 11 26 8 11 39 8 20 29 8 20 30 8 23 24 8 23 26 8 23 28 8 24 27 8 27 39 8 29 36 8 30 37 8 31 36 8 31 37 8 9 10 8 9 26 8 $$$$