ENAMINE-ZINC03455902 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -1.3980 1.9560 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 1.1820 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.7710 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 3.1470 0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 3.9930 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 5.2920 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 3.8980 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 3.2970 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 6.4540 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 6.4620 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 7.6310 0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 8.9310 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 10.0890 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 11.4460 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 12.1080 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 13.3820 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 13.9960 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 13.3430 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 12.0700 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 15.6560 0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 15.7110 1.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 15.6140 -1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 16.6640 -0.0970 N 0 5 0 0 0 0 0 0 0 0 0 0 2.2620 16.5530 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 1.4230 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.1030 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.2310 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 3.5750 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 3.9120 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 7.6340 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 8.9870 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 8.9600 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 9.9960 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 10.0220 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 11.6430 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 13.8930 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 13.8260 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 11.5740 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 5.1800 -0.1360 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3620 5.9270 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 9 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 39 2 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 39 1 M END