5204584 -OEChem-05092402052D 65 68 0 1 0 0 0 0 0999 V2000 4.5981 0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2862 -2.5347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2862 -0.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7942 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3923 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 -2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 -0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4014 -2.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8032 -1.9147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8032 -1.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4014 -0.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -3.5000 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 9 1 0 0 0 0 1 11 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 25 1 0 0 0 0 5 32 1 0 0 0 0 6 29 1 0 0 0 0 6 33 1 0 0 0 0 7 23 2 0 0 0 0 8 30 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 26 1 0 0 0 0 10 30 1 0 0 0 0 10 59 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 19 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 17 1 0 0 0 0 13 20 1 0 0 0 0 14 21 2 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 27 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 24 30 1 0 0 0 0 24 36 1 0 0 0 0 24 51 1 0 0 0 0 25 29 2 0 0 0 0 25 31 1 0 0 0 0 26 31 2 0 0 0 0 26 35 1 0 0 0 0 27 34 2 0 0 0 0 27 52 1 0 0 0 0 28 34 1 0 0 0 0 28 53 1 0 0 0 0 29 37 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 60 1 0 0 0 0 35 37 2 0 0 0 0 35 61 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 62 1 0 0 0 0 M END > 5204584 > 1 > 886 > 8 > 1 > 9 > AAADceB7OABAAAAAAAAAAAAAAAAAAAAAAAA0YMEAAAAAAACRUAAAHgQQQAAADBzh2AYyz4LABAKIAiXSWHLCCBAlIgAIiBlO7MgPJjLEtZ+HOSrm1Bna6Ye42DOOQEAAggAEQACAgAEEAAiAAAAAAAAAAA== > [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-2-oxo-ethyl] 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoate > 3-[ethyl(phenyl)sulfamoyl]-4-methylbenzoic acid [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] ester > [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3-[ethyl(phenyl)sulfamoyl]-4-methylbenzoate > [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3-[ethyl(phenyl)sulfamoyl]-4-methylbenzoate > [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl] 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoate > 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoic acid [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-1-methyl-ethyl] ester > InChI=1S/C27H28N2O7S/c1-4-29(22-8-6-5-7-9-22)37(32,33)25-16-20(11-10-18(25)2)27(31)36-19(3)26(30)28-21-12-13-23-24(17-21)35-15-14-34-23/h5-13,16-17,19H,4,14-15H2,1-3H3,(H,28,30) > QZXPNTYGSCOCNN-UHFFFAOYSA-N > 4.2 > 524.16172241 > C27H28N2O7S > 524.6 > CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)NC3=CC4=C(C=C3)OCCO4)C > CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)NC3=CC4=C(C=C3)OCCO4)C > 120 > 524.16172241 > 0 > 37 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 13 8 11 15 8 13 17 8 14 21 8 14 22 8 15 16 8 16 18 8 17 18 8 21 27 8 22 28 8 24 36 3 25 29 8 25 31 8 26 31 8 26 35 8 27 34 8 28 34 8 29 37 8 35 37 8 $$$$