HMDB0245710 RDKit 3D 4-(5-Fluoro-1,3-benzothiazol-2-yl)-2-methylaniline 29 31 0 0 0 0 0 0 0 0999 V2000 -3.9290 1.3266 1.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 0.4658 0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6356 0.6506 0.6451 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -0.1551 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6709 0.0323 -0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6224 -0.6345 -0.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8706 -0.3223 -0.4429 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9863 -0.9482 -1.0356 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2397 -0.5317 -0.7611 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2909 -1.1758 -1.3652 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5306 0.5047 0.0918 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4525 1.1294 0.6812 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 0.7148 0.4117 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 1.1769 0.8945 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3496 -1.1341 -0.8709 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7048 -1.3454 -0.9669 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5306 -0.5201 -0.2242 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9287 -0.7313 -0.3176 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 0.6802 1.7834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4233 1.8617 2.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4524 2.0629 0.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2319 1.4305 1.2757 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -1.7804 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5558 0.7674 0.2507 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 1.9479 1.3611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6863 -1.7667 -1.4421 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0587 -2.1307 -1.6051 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5582 0.0306 0.0146 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3347 -1.6060 -0.6998 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 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 9 10 1 0 9 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 4 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 2 1 0 14 5 1 0 13 7 1 0 1 19 1 0 1 20 1 0 1 21 1 0 3 22 1 0 8 23 1 0 11 24 1 0 12 25 1 0 15 26 1 0 16 27 1 0 18 28 1 0 18 29 1 0 M END