24210117 -OEChem-05062409102D 76 80 0 0 0 0 0 0 0999 V2000 7.7722 -1.0592 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5043 4.9408 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2838 6.0340 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -1.4110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7722 0.9407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5043 4.9408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5043 4.9408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9632 -2.6470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2722 -3.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5812 -2.6470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5043 0.9407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5043 5.9408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4748 7.4353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9211 -6.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5089 -6.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 -7.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7301 -7.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -6.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5034 -6.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1021 -5.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6844 -4.4071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0912 -5.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6899 -4.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2722 -3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0121 -2.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7722 -2.0592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -3.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 -1.3599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3179 -2.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 -1.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -1.7200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6382 -0.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5043 3.9408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6382 0.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5043 1.9408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3703 3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6382 3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3703 2.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6382 2.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -0.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3703 6.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9530 6.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4530 7.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8317 -7.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9689 -8.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8349 -8.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3657 -7.9235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2317 -7.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0945 -6.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4765 -5.7448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6105 -5.8820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7476 -6.7480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7556 -6.6961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4855 -5.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7078 -5.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4377 -3.7362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3979 -3.6136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -0.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8572 -3.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7243 -0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8503 -1.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2488 -0.4516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0412 0.6307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9072 3.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1013 3.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9072 2.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1013 2.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5707 -0.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0373 0.1811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9673 6.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 0.4658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 0.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -0.7135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5696 6.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7051 8.2096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 32 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 12 1 0 0 0 0 2 33 1 0 0 0 0 3 41 1 0 0 0 0 3 43 1 0 0 0 0 4 31 1 0 0 0 0 4 40 1 0 0 0 0 5 34 2 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 24 2 0 0 0 0 10 26 2 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 64 1 0 0 0 0 12 41 1 0 0 0 0 12 71 1 0 0 0 0 13 41 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 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 19 54 1 0 0 0 0 20 23 2 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 27 29 1 0 0 0 0 27 58 1 0 0 0 0 28 30 2 0 0 0 0 28 59 1 0 0 0 0 29 31 2 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 32 34 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 36 2 0 0 0 0 33 37 1 0 0 0 0 35 38 2 0 0 0 0 35 39 1 0 0 0 0 36 38 1 0 0 0 0 36 65 1 0 0 0 0 37 39 2 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 39 68 1 0 0 0 0 40 42 1 0 0 0 0 40 69 1 0 0 0 0 40 70 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 43 44 2 0 0 0 0 43 75 1 0 0 0 0 44 76 1 0 0 0 0 M END > 24210117 > 1 > 1020 > 10 > 2 > 12 > AAADcfB7uABgAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAAAB9AAAHgQYQAAADgzl2wa/15fMFAquAjd3dHDS+LtxKrldyDw+bJiMLqLEuZuGOCjk3BPI6CewwMAPwEQAAAAAAACAiAAAAAAAAAAAAAAAAA== > 2-[[5-(4-tert-butylphenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide > 2-[[5-(4-tert-butylphenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-[4-(2-thiazolylsulfamoyl)phenyl]acetamide > 2-[[5-(4-tert-butylphenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide > 2-[[5-(4-tert-butylphenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide > 2-[[5-(4-tert-butylphenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]ethanamide > 2-[[5-(4-tert-butylphenyl)-4-p-phenetyl-1,2,4-triazol-3-yl]thio]-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide > InChI=1S/C31H32N6O4S3/c1-5-41-25-14-12-24(13-15-25)37-28(21-6-8-22(9-7-21)31(2,3)4)34-35-30(37)43-20-27(38)33-23-10-16-26(17-11-23)44(39,40)36-29-32-18-19-42-29/h6-19H,5,20H2,1-4H3,(H,32,36)(H,33,38) > ZSHRKDDXJFWEOD-UHFFFAOYSA-N > 6.4 > 648.16471704 > C31H32N6O4S3 > 648.8 > CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)C5=CC=C(C=C5)C(C)(C)C > CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)C5=CC=C(C=C5)C(C)(C)C > 190 > 648.16471704 > 0 > 44 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 26 8 13 41 8 13 44 8 15 19 8 15 20 8 19 22 8 20 23 8 21 22 8 21 23 8 25 27 8 25 28 8 27 29 8 28 30 8 29 31 8 3 41 8 3 43 8 30 31 8 33 36 8 33 37 8 35 38 8 35 39 8 36 38 8 37 39 8 43 44 8 8 24 8 8 26 8 9 10 8 9 24 8 $$$$