HMDB0249921 RDKit 3D 2-[[2-[(Dimethylamino)methyl]phenyl]thio]-5-fluoroaniline 36 37 0 0 0 0 0 0 0 0999 V2000 -3.1038 1.2159 1.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0721 0.8632 -0.1593 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3553 2.0409 -0.9612 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8354 0.3257 -0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3957 -0.9340 -0.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0984 -1.6546 0.9252 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6548 -2.8560 1.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4749 -3.3719 1.0326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2506 -2.6921 0.0905 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2027 -1.4779 -0.4419 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8581 -0.7425 -1.6669 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0975 0.3063 -0.9528 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8699 1.6394 -0.8086 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8413 2.4472 -0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0283 1.9128 0.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0174 2.6505 0.7354 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 0.5768 0.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3092 -0.2577 -0.5323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5046 -1.6544 -0.7041 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1989 2.3402 1.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2275 0.8845 1.8184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0512 0.8341 1.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5527 2.7794 -0.7397 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3641 2.4523 -0.7687 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2594 1.7293 -2.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8747 0.2793 -1.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0547 1.0958 -0.3791 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0373 -1.2782 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2402 -3.3905 2.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0934 -4.3180 1.4291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1882 -3.1370 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9252 2.0959 -1.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6637 3.5046 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1888 0.1313 0.3503 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5588 -2.0645 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5947 -2.2760 0.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 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 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 10 5 1 0 18 12 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 6 28 1 0 7 29 1 0 8 30 1 0 9 31 1 0 13 32 1 0 14 33 1 0 17 34 1 0 19 35 1 0 19 36 1 0 M END