HMDB0040086 RDKit 3D 2-Butyl-5-ethyl-4-methylthiazole 29 29 0 0 0 0 0 0 0 0999 V2000 -4.5176 0.2747 0.9865 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1176 0.0863 -0.4481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6542 0.4531 -0.6861 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8563 -0.4564 0.1988 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3696 -0.2152 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.7815 -0.7576 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.4482 -0.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7876 -1.0561 -1.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.5037 0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4815 1.0794 0.4402 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3001 0.0707 1.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6315 0.8596 0.9487 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1274 1.2259 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6351 0.2203 1.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1133 -0.5329 1.6327 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7367 0.7531 -1.0807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -0.9354 -0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4445 0.2043 -1.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4837 1.5242 -0.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0825 -1.5060 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0962 -0.3569 1.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1984 -1.9564 -1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5509 -0.3220 -1.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3051 -1.4326 -2.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0037 1.2291 -0.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3975 1.9990 1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3374 0.4124 1.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8834 0.0321 2.2543 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -0.9283 0.7509 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 1 0 7 9 2 0 9 10 1 0 10 11 1 0 9 12 1 0 12 5 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 8 22 1 0 8 23 1 0 8 24 1 0 10 25 1 0 10 26 1 0 11 27 1 0 11 28 1 0 11 29 1 0 M END