HMDB0250425 RDKit 3D 1-(4-Methanesulfonamidophenoxy)-3-(N-methyl-3,4-dichlorophenylethylamino)-2-p... 52 53 0 0 0 0 0 0 0 0999 V2000 -3.2406 -0.6699 -1.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5422 -0.0792 -0.0107 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0032 1.1446 0.5347 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2463 1.0821 1.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4765 0.6243 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3922 1.3668 0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5459 0.8246 -0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8496 -0.5251 -0.3308 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3240 -1.1945 -0.9908 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.9339 -1.2818 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2895 -2.9994 0.5496 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7854 -0.7376 0.8566 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4432 -0.6090 0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -0.7252 -0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -1.5437 -1.2866 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4621 0.5868 -0.4805 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 0.5433 -1.0052 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9404 0.1526 -0.5858 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2139 -0.3489 0.6553 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5028 -0.7201 0.9679 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5523 -0.6110 0.0821 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8707 -1.0030 0.4511 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2669 -0.0732 0.1475 S 0 0 0 0 0 6 0 0 0 0 0 0 8.2212 1.5036 0.9604 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5041 -0.8406 0.5224 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3701 0.1602 -1.3519 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2793 -0.1045 -1.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0048 0.2716 -1.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0936 0.0066 -1.3484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6133 -0.6812 -1.9913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6897 -1.6666 -0.8715 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1915 1.4787 1.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9602 1.9606 -0.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0414 0.4453 2.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4701 2.0876 1.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1979 2.4096 -0.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2456 1.4657 -1.0074 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1112 -1.3975 1.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1948 0.0158 1.5301 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6554 -1.6211 1.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5292 -1.2920 0.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5926 -2.4245 -0.9598 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4787 1.2928 0.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1934 1.0256 -1.3054 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 -0.4412 1.3884 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6974 -1.1231 1.9725 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9763 -1.9198 0.9383 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0855 1.5417 1.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3023 1.6570 1.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3928 2.3295 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1137 -0.0140 -1.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8076 0.6708 -2.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 2 0 2 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 2 0 23 26 2 0 21 27 1 0 27 28 2 0 12 5 1 0 28 18 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 6 36 1 0 7 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 15 42 1 0 16 43 1 0 16 44 1 0 19 45 1 0 20 46 1 0 22 47 1 0 24 48 1 0 24 49 1 0 24 50 1 0 27 51 1 0 28 52 1 0 M END