69994316 -OEChem-05112407482D 82 86 0 1 0 0 0 0 0999 V2000 10.3759 3.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4061 3.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4061 1.2858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8154 3.9723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6682 3.3100 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.9362 3.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8022 1.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9362 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3266 4.9874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3154 4.8383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5935 4.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 3.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4945 2.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8126 4.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8022 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2465 4.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2437 5.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0702 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0702 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9362 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6776 5.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1762 3.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1762 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2702 2.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2702 1.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0847 12.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 12.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0847 13.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 11.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4099 4.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5381 1.7825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3527 12.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9786 12.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 14.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9786 14.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3527 13.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8847 12.5992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8847 13.6408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3527 10.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0847 10.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3527 9.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0847 9.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 9.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5531 5.5645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8143 5.3366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9079 5.0211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2691 5.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2835 4.8441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0011 4.1245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4964 2.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0631 2.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 2.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8045 2.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3082 5.5649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6497 5.1159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1820 4.4058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8405 4.8548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2362 5.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9466 6.4823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 6.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1834 3.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1834 0.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4731 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3993 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0299 4.3318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 4.9541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7899 4.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8157 12.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8461 2.3206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2302 1.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9715 11.4654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 14.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9715 14.7746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8157 13.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4204 12.2871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4204 13.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8157 10.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6216 10.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8157 9.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6216 9.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 8.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 24 1 0 0 0 0 2 30 1 0 0 0 0 3 25 1 0 0 0 0 3 31 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 6 18 1 0 0 0 0 7 15 1 0 0 0 0 7 20 2 0 0 0 0 8 20 1 0 0 0 0 8 63 1 0 0 0 0 8 64 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 21 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 24 1 0 0 0 0 22 61 1 0 0 0 0 23 25 1 0 0 0 0 23 62 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 2 0 0 0 0 27 29 1 0 0 0 0 27 32 2 0 0 0 0 28 34 1 0 0 0 0 28 35 2 0 0 0 0 29 39 2 0 0 0 0 29 40 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 32 36 1 0 0 0 0 32 68 1 0 0 0 0 33 37 1 0 0 0 0 33 72 1 0 0 0 0 34 36 2 0 0 0 0 34 73 1 0 0 0 0 35 38 1 0 0 0 0 35 74 1 0 0 0 0 36 75 1 0 0 0 0 37 38 2 0 0 0 0 37 76 1 0 0 0 0 38 77 1 0 0 0 0 39 41 1 0 0 0 0 39 78 1 0 0 0 0 40 42 2 0 0 0 0 40 79 1 0 0 0 0 41 43 2 0 0 0 0 41 80 1 0 0 0 0 42 43 1 0 0 0 0 42 81 1 0 0 0 0 43 82 1 0 0 0 0 M END > 69994316 > 1 > 708 > 7 > 1 > 6 > AAADcfB/sAAAAAAAAAAAAAAAAAAAAAAAAAA8YMGCBYAAAADx9AAAHgAQAAAADAzBngYz9vdIFACoAydydACCiCkhIqAJmCE+7JiNbrLE+duUNCpuxhvK6Cew0NMOoEADAgASQABAgAYEACSAAAAAAAAAAA== > 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;1-phenylnaphthalene > 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1,4-diazepan-1-yl]-1-butanone;1-phenylnaphthalene > 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;1-phenylnaphthalene > 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;1-phenylnaphthalene > 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;1-phenylnaphthalene > 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;1-phenylnaphthalene > InChI=1S/C19H27N5O3.C16H12/c1-4-6-17(25)23-7-5-8-24(10-9-23)19-21-14-12-16(27-3)15(26-2)11-13(14)18(20)22-19;1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16/h11-12H,4-10H2,1-3H3,(H2,20,21,22);1-12H > PMQRXYKCSMYUHD-UHFFFAOYSA-N > 577.30529012 > C35H39N5O3 > 577.7 > CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.C1=CC=C(C=C1)C2=CC=CC3=CC=CC=C32 > CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.C1=CC=C(C=C1)C2=CC=CC3=CC=CC=C32 > 93.8 > 577.30529012 > 0 > 43 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 18 19 8 18 22 8 19 20 8 19 23 8 22 24 8 23 25 8 24 25 8 26 27 8 26 28 8 26 33 8 27 32 8 28 34 8 28 35 8 29 39 8 29 40 8 32 36 8 33 37 8 34 36 8 35 38 8 37 38 8 39 41 8 40 42 8 41 43 8 42 43 8 6 15 8 6 18 8 7 15 8 7 20 8 $$$$