69446610 -OEChem-03182422512D 48 50 0 1 0 0 0 0 0999 V2000 10.0354 2.0303 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -1.7866 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.6842 0.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6842 -0.7690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3926 2.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4635 -2.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2544 -0.7921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5737 1.0586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9749 2.0766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3535 -1.6821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2264 0.6290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -1.8911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 0.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5627 1.2676 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1615 0.2495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7547 -0.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5572 1.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7602 -0.7685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0572 2.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1399 1.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0059 0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9804 1.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 1.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0059 -0.4643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 -0.4643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 -0.9643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2678 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1127 -0.2644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7576 0.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8149 1.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2047 0.8680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5599 0.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7115 -1.2825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3563 -0.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8035 -0.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1586 -0.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2271 2.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8051 2.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7179 -2.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 1.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4690 -0.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 -1.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7287 -0.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7287 0.4505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 -2.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 2.7163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 24 1 0 0 0 0 3 28 1 0 0 0 0 4 26 1 0 0 0 0 4 28 1 0 0 0 0 5 22 1 0 0 0 0 5 48 1 0 0 0 0 8 22 2 0 0 0 0 9 14 1 0 0 0 0 9 22 1 0 0 0 0 9 38 1 0 0 0 0 10 18 1 0 0 0 0 10 40 1 0 0 0 0 11 17 1 0 0 0 0 11 20 2 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 2 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 23 2 0 0 0 0 21 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END > 69446610 > 1 > 631 > 10 > 4 > 9 > AAADceB7uABgAAAAAAAAAAAAAAAAAWJAAAAwAAAAAAAAAEgBwAAAHgQQSAAADCzF3gewj5LIFgisAyRiXDCC+KBhKjgIiLQ+rJkdZqKksRu0MCpk1hGuqAew0BIOIAABAAAAQABAAAIAAACAAAAAAAAAAA== > [1-[2-(1,3-benzodioxol-5-yl)thiazol-4-yl]-5-(sulfamoylamino)pentyl]carbamic acid > [1-[2-(1,3-benzodioxol-5-yl)-4-thiazolyl]-5-(sulfamoylamino)pentyl]carbamic acid > [1-[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]-5-(sulfamoylamino)pentyl]carbamic acid > [1-[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]-5-(sulfamoylamino)pentyl]carbamic acid > [1-[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]-5-(sulfamoylamino)pentyl]carbamic acid > [1-[2-(1,3-benzodioxol-5-yl)thiazol-4-yl]-5-(sulfamoylamino)pentyl]carbamic acid > InChI=1S/C16H20N4O6S2/c17-28(23,24)18-6-2-1-3-11(20-16(21)22)12-8-27-15(19-12)10-4-5-13-14(7-10)26-9-25-13/h4-5,7-8,11,18,20H,1-3,6,9H2,(H,21,22)(H2,17,23,24) > ZVBMAKFNOQLDPW-UHFFFAOYSA-N > 1.2 > 428.08242672 > C16H20N4O6S2 > 428.5 > C1OC2=C(O1)C=C(C=C2)C3=NC(=CS3)C(CCCCNS(=O)(=O)N)NC(=O)O > C1OC2=C(O1)C=C(C=C2)C3=NC(=CS3)C(CCCCNS(=O)(=O)N)NC(=O)O > 190 > 428.08242672 > 0 > 28 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 19 8 1 20 8 11 17 8 11 20 8 14 13 3 17 19 8 21 23 8 21 25 8 23 24 8 24 26 8 25 27 8 26 27 8 $$$$