HMDB0257267 RDKit 3D 3,4-Dimethoxy-N-(4-(3-nitrophenyl)thiazol-2-yl)benzenesulfonamide 43 45 0 0 0 0 0 0 0 0999 V2000 -5.3572 -1.6751 2.7534 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0309 -0.5762 1.9465 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1974 -0.7697 0.8598 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6621 -1.9945 0.5193 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8438 -2.1827 -0.5475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5016 -1.1264 -1.3622 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4665 -1.3509 -2.7585 S 0 0 0 0 0 6 0 0 0 0 0 0 -1.8917 -2.5351 -3.5711 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5297 -0.0771 -3.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1436 -1.4872 -2.2192 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7346 -0.3847 -1.5253 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.2947 -1.0304 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 0.7836 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7203 0.9021 0.1363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0752 2.0535 0.7563 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 2.1619 1.2828 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2255 1.1178 1.1641 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8928 -0.0621 0.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7917 -1.1399 0.4202 N 0 0 0 0 0 4 0 0 0 0 0 0 6.4549 -2.1896 -0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0439 -1.0367 0.9321 O 0 0 0 0 0 1 0 0 0 0 0 0 4.6112 -0.1373 0.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 1.8107 -0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0819 1.1428 -1.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0172 0.1154 -1.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 0.2877 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3307 1.5632 0.2857 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9944 2.6596 -0.5342 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9006 -1.3694 3.6708 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -2.1825 3.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9855 -2.3854 2.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9266 -2.8383 1.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4551 -3.1579 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6949 -2.3423 -2.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4212 2.9256 0.8809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6836 3.0548 1.7813 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2484 1.1640 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3421 -1.0803 -0.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5552 2.7988 0.1309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7974 1.0030 -1.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8991 2.8351 -0.4748 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4945 3.5880 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2732 2.4085 -1.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 2 0 7 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 22 2 0 13 23 2 0 23 24 1 0 6 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 26 3 1 0 24 11 1 0 22 14 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 5 33 1 0 10 34 1 0 15 35 1 0 16 36 1 0 17 37 1 0 22 38 1 0 23 39 1 0 25 40 1 0 28 41 1 0 28 42 1 0 28 43 1 0 M CHG 2 19 1 21 -1 M END