70594839 -OEChem-04242407212D 89 92 0 1 0 0 0 0 0999 V2000 4.4973 3.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4973 10.6364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4973 1.2858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4973 8.5881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 6.0414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7595 3.3100 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7595 10.6123 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.4915 4.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4915 11.6123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 3.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 10.6123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8934 1.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8934 9.1123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 7.6123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4915 3.3100 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4915 10.6123 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6255 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6255 10.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7595 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7595 11.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6255 4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6255 12.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3575 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3575 10.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8934 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8934 10.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 10.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 9.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0274 8.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2674 3.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2674 10.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2674 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2674 8.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3614 2.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3614 10.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3614 1.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3614 9.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5012 4.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5012 11.6364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6293 1.7825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6293 9.0848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0285 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0285 10.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 2.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0240 2.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 9.6374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0240 9.6374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5474 4.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1489 4.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5474 12.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1489 11.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0240 5.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 5.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0240 12.5872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 12.5872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0285 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0285 11.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0475 2.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8945 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6675 3.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0475 9.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8945 9.8023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6675 10.6492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2746 3.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2746 11.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2746 0.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2746 7.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5643 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4905 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5643 7.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4905 7.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1211 4.3318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5035 4.9541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8812 4.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1211 11.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5035 12.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8812 11.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9373 2.3206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0912 2.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3214 1.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9373 9.6229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0912 9.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3214 8.5467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0739 6.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 1 42 1 0 0 0 0 2 39 1 0 0 0 0 2 43 1 0 0 0 0 3 40 1 0 0 0 0 3 44 1 0 0 0 0 4 41 1 0 0 0 0 4 45 1 0 0 0 0 5 88 1 0 0 0 0 5 89 1 0 0 0 0 6 18 1 0 0 0 0 6 20 1 0 0 0 0 6 26 1 0 0 0 0 7 19 1 0 0 0 0 7 21 1 0 0 0 0 7 27 1 0 0 0 0 8 16 1 0 0 0 0 8 22 1 0 0 0 0 8 60 1 0 0 0 0 9 17 1 0 0 0 0 9 23 1 0 0 0 0 9 61 1 0 0 0 0 10 26 2 0 0 0 0 10 28 1 0 0 0 0 11 27 2 0 0 0 0 11 29 1 0 0 0 0 12 26 1 0 0 0 0 12 32 2 0 0 0 0 13 27 1 0 0 0 0 13 33 2 0 0 0 0 14 32 1 0 0 0 0 14 72 1 0 0 0 0 14 73 1 0 0 0 0 15 33 1 0 0 0 0 15 74 1 0 0 0 0 15 75 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 22 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 23 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 28 30 1 0 0 0 0 28 34 2 0 0 0 0 29 31 1 0 0 0 0 29 35 2 0 0 0 0 30 32 1 0 0 0 0 30 36 2 0 0 0 0 31 33 1 0 0 0 0 31 37 2 0 0 0 0 34 38 1 0 0 0 0 34 68 1 0 0 0 0 35 39 1 0 0 0 0 35 69 1 0 0 0 0 36 40 1 0 0 0 0 36 70 1 0 0 0 0 37 41 1 0 0 0 0 37 71 1 0 0 0 0 38 40 2 0 0 0 0 39 41 2 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 42 78 1 0 0 0 0 43 79 1 0 0 0 0 43 80 1 0 0 0 0 43 81 1 0 0 0 0 44 82 1 0 0 0 0 44 83 1 0 0 0 0 44 84 1 0 0 0 0 45 85 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 M END > 70594839 > 1 > 372 > 15 > 5 > 6 > AAADcfB7+AAAAAAAAAAAAAAAAAAAAAAAAAA8eLFiAAAAAACx/gAAHgAQCAAADCzBngYz9vfIFACgAyZiZACCiCkhIqABmKA+7JiNbqLE+NuUNCpu0BvK6Cew0BMOIEABAgACQABAgAIEAASAAAAAAAAAAA== > 6,7-dimethoxy-2-(3-methylpiperazin-1-yl)quinazolin-4-amine;hydrate > 6,7-dimethoxy-2-(3-methyl-1-piperazinyl)-4-quinazolinamine;hydrate > 6,7-dimethoxy-2-(3-methylpiperazin-1-yl)quinazolin-4-amine;hydrate > 6,7-dimethoxy-2-(3-methylpiperazin-1-yl)quinazolin-4-amine;hydrate > 6,7-dimethoxy-2-(3-methylpiperazin-1-yl)quinazolin-4-amine;hydrate > [6,7-dimethoxy-2-(3-methylpiperazino)quinazolin-4-yl]amine;hydrate > InChI=1S/2C15H21N5O2.H2O/c2*1-9-8-20(5-4-17-9)15-18-11-7-13(22-3)12(21-2)6-10(11)14(16)19-15;/h2*6-7,9,17H,4-5,8H2,1-3H3,(H2,16,18,19);1H2 > WVXJIESZUJRDJZ-UHFFFAOYSA-N > 624.34961454 > C30H44N10O5 > 624.7 > CC1CN(CCN1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.CC1CN(CCN1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.O > CC1CN(CCN1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.CC1CN(CCN1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.O > 172 > 624.34961454 > 0 > 45 > 0 > 2 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 10 26 8 10 28 8 11 27 8 11 29 8 12 26 8 12 32 8 13 27 8 13 33 8 16 24 3 17 25 3 28 30 8 28 34 8 29 31 8 29 35 8 30 32 8 30 36 8 31 33 8 31 37 8 34 38 8 35 39 8 36 40 8 37 41 8 38 40 8 39 41 8 $$$$