644662 -OEChem-05042414052D 59 63 0 0 0 0 0 0 0999 V2000 10.1279 1.9010 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.1279 1.9010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1279 -3.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2157 -3.2381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1279 0.1690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1279 -1.5630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 2.7058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 1.0963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 1.0350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1279 0.1690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1279 -1.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6279 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 1.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6279 -2.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 1.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6279 -2.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2157 -1.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1667 -1.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1667 -2.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 2.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 2.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 1.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1530 -0.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1530 -1.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7105 0.3810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0202 0.7796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5453 -1.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2356 -2.1736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1029 -1.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1029 -0.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0453 0.8230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7356 0.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0241 -1.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 3.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6683 -1.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6683 -3.2935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 3.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9379 3.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.4380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.4380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 0.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 27 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 17 1 0 0 0 0 4 29 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 18 1 0 0 0 0 7 21 1 0 0 0 0 7 46 1 0 0 0 0 8 19 1 0 0 0 0 8 21 2 0 0 0 0 9 27 2 0 0 0 0 9 34 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 25 1 0 0 0 0 20 28 1 0 0 0 0 20 45 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 22 32 1 0 0 0 0 23 25 2 0 0 0 0 23 33 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 30 1 0 0 0 0 26 34 2 0 0 0 0 27 31 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M END > 644662 > 1 > 733 > 6 > 1 > 5 > AAADceB7sABAAAAAAAAAAAAAAAAAAWJAAAA8WIAAAAAAAFgB/gAAHgQQAAAADAzl3wa/1bfJlEioA7939AKC2C31OrAJ2Tn+fNiObvLk/b+XOSjs1hP46aeYl4IOiAAAQAAQACAQAACAACAAQAAAAAAAAA== > 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone > 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethanone > 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone > 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone > 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone > 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]-1-[4-(2-furoyl)piperazino]ethanone > InChI=1S/C25H25N5O3S/c1-16-12-19-20(13-17(16)2)28-24(27-19)18-5-6-22(26-14-18)34-15-23(31)29-7-9-30(10-8-29)25(32)21-4-3-11-33-21/h3-6,11-14H,7-10,15H2,1-2H3,(H,27,28) > XRDOQFVKEXQRKF-UHFFFAOYSA-N > 3.5 > 475.16781085 > C25H25N5O3S > 475.6 > CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCN(CC4)C(=O)C5=CC=CO5 > CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCN(CC4)C(=O)C5=CC=CO5 > 121 > 475.16781085 > 0 > 34 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 17 20 8 18 19 8 18 24 8 19 25 8 20 28 8 22 23 8 22 24 8 23 25 8 26 30 8 26 34 8 27 31 8 28 29 8 30 31 8 4 17 8 4 29 8 7 18 8 7 21 8 8 19 8 8 21 8 9 27 8 9 34 8 $$$$