24891770 -OEChem-05132414272D 68 71 0 0 0 0 0 0 0999 V2000 11.9327 3.2087 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.6236 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 5.9896 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 4.2576 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.9327 4.9407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.1236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4029 5.4407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3491 4.1360 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6598 6.6960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 4.4407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4327 2.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4327 2.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9327 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9327 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4327 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4327 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4327 4.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4327 4.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9327 4.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9327 4.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9327 4.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4327 5.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4327 5.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3491 5.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4029 4.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9919 7.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5368 5.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5368 3.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3026 8.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4327 5.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 5.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2811 8.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6347 9.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 9.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9454 10.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9239 10.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 5.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1227 2.8796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5404 2.9532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8501 2.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4076 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4076 1.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4578 1.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4578 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3250 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0153 0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8501 0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5404 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1227 3.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7427 6.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1227 6.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2664 6.8238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4450 7.7323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6094 6.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5368 6.5607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5368 3.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9696 5.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7427 6.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8958 6.1167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1339 5.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6951 8.1355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0280 9.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1984 9.6754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5313 10.5471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 10.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 38 1 0 0 0 0 3 38 1 0 0 0 0 4 38 1 0 0 0 0 5 20 1 0 0 0 0 5 31 1 0 0 0 0 6 39 1 0 0 0 0 6 68 1 0 0 0 0 7 39 2 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 28 1 0 0 0 0 9 22 1 0 0 0 0 9 26 2 0 0 0 0 10 25 1 0 0 0 0 10 27 1 0 0 0 0 10 54 1 0 0 0 0 11 29 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 13 15 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 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 19 51 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 25 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 26 29 1 0 0 0 0 27 30 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 32 2 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 35 1 0 0 0 0 33 63 1 0 0 0 0 34 36 2 0 0 0 0 34 64 1 0 0 0 0 35 37 2 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 38 39 1 0 0 0 0 M END > 24891770 > 1 > 652 > 10 > 2 > 7 > AAADceB7sYBAAAAAAAAAAAAAAAAAAWAAAAA8YMEAAAAAAFgB9AAAHwQQCAAADAzF3xa/v5/MHgioAzb3bACCiC0xOrAJ2Lo+fJiMbuLkuRuUMChswBPo6CeQ0IMOIAAAgAAAIABAAAEAAABAAAAAAAAAAA== > N-benzyl-2-(3-cyclohexylsulfanyl-4-methoxy-phenyl)imidazo[1,2-a]pyrazin-3-amine;2,2,2-trifluoroacetic acid > 2-[3-(cyclohexylthio)-4-methoxyphenyl]-N-(phenylmethyl)-3-imidazo[1,2-a]pyrazinamine;2,2,2-trifluoroacetic acid > N-benzyl-2-(3-cyclohexylsulfanyl-4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine;2,2,2-trifluoroacetic acid > N-benzyl-2-(3-cyclohexylsulfanyl-4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine;2,2,2-trifluoroacetic acid > 2-(3-cyclohexylsulfanyl-4-methoxy-phenyl)-N-(phenylmethyl)imidazo[1,2-a]pyrazin-3-amine;2,2,2-tris(fluoranyl)ethanoic acid > benzyl-[2-[3-(cyclohexylthio)-4-methoxy-phenyl]imidazo[1,2-a]pyrazin-3-yl]amine;2,2,2-trifluoroacetic acid > InChI=1S/C26H28N4OS.C2HF3O2/c1-31-22-13-12-20(16-23(22)32-21-10-6-3-7-11-21)25-26(28-17-19-8-4-2-5-9-19)30-15-14-27-18-24(30)29-25;3-2(4,5)1(6)7/h2,4-5,8-9,12-16,18,21,28H,3,6-7,10-11,17H2,1H3;(H,6,7) > ZWSIKLZUAPJXAF-UHFFFAOYSA-N > 558.19124646 > C28H29F3N4O3S > 558.6 > COC1=C(C=C(C=C1)C2=C(N3C=CN=CC3=N2)NCC4=CC=CC=C4)SC5CCCCC5.C(=O)(C(F)(F)F)O > COC1=C(C=C(C=C1)C2=C(N3C=CN=CC3=N2)NCC4=CC=CC=C4)SC5CCCCC5.C(=O)(C(F)(F)F)O > 114 > 558.19124646 > 0 > 39 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 11 29 8 11 32 8 18 19 8 18 20 8 19 21 8 20 23 8 21 24 8 22 25 8 23 24 8 26 29 8 28 32 8 30 33 8 30 34 8 33 35 8 34 36 8 35 37 8 36 37 8 8 25 8 8 26 8 8 28 8 9 22 8 9 26 8 $$$$