70578992 -OEChem-05062417082D 75 78 0 0 0 0 0 0 0999 V2000 6.7320 -0.1134 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 10.4908 1.2546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0794 1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.8749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -2.9232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2641 -1.3990 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.9962 -2.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3774 -0.0722 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 1.5554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.8990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.8990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1301 -0.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2641 -2.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4378 -0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9962 -1.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1301 -2.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6718 0.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1435 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5511 0.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8454 1.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0832 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9587 2.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -1.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -2.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8492 -1.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8984 2.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -2.9337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 3.8670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7889 -0.6737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0117 4.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5287 -0.4241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7316 -0.4241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6535 -2.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -2.9816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6067 -1.5067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2082 -0.8164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7316 -3.3740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5287 -3.3740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5331 -2.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6685 -1.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4535 -1.2519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5581 0.0255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7732 0.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8510 3.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3387 2.5402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3743 -1.4143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1592 -1.5527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 2.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5184 2.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -0.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -3.5537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9644 4.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4520 3.8670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0010 -1.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3715 -0.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5769 -0.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8611 -4.2090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -4.2090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2238 3.6264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5943 4.4211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7997 4.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 0.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 0.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 0.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 -1.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -2.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -2.9647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 21 2 0 0 0 0 3 22 2 0 0 0 0 4 34 1 0 0 0 0 4 37 1 0 0 0 0 5 35 1 0 0 0 0 5 38 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 47 1 0 0 0 0 8 15 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 24 1 0 0 0 0 10 18 2 0 0 0 0 10 25 1 0 0 0 0 11 18 1 0 0 0 0 11 26 2 0 0 0 0 12 26 1 0 0 0 0 12 65 1 0 0 0 0 12 66 1 0 0 0 0 13 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 17 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 19 2 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 23 28 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 29 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 27 1 0 0 0 0 25 30 2 0 0 0 0 26 27 1 0 0 0 0 27 31 2 0 0 0 0 28 33 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 32 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 34 1 0 0 0 0 30 58 1 0 0 0 0 31 35 1 0 0 0 0 31 59 1 0 0 0 0 32 36 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 35 2 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 37 72 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 M CHG 1 6 1 M END > 70578992 > 1 > 884 > 8 > 2 > 10 > AAADcfB7uAAAEAAAAAAAAAAAAAAAAAAAAAA8WIEAAAAAAACx8AAAHgBQAAABjAzBngYz9vfIFACoAydydACCiCkhIqABmKA+7NitbqLE+NuUNCpu1zvK6Gew0BMOIEABAgACQABAgAIEAASAAAAAAAAAAA== > 6-[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-ium-1-yl]-5-bromo-1,3-dibutyl-pyrimidine-2,4-dione > 6-[1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazin-1-iumyl]-5-bromo-1,3-dibutylpyrimidine-2,4-dione > 6-[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-ium-1-yl]-5-bromo-1,3-dibutylpyrimidine-2,4-dione > 6-[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-ium-1-yl]-5-bromo-1,3-dibutylpyrimidine-2,4-dione > 6-[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-ium-1-yl]-5-bromanyl-1,3-dibutyl-pyrimidine-2,4-dione > 6-[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-ium-1-yl]-5-bromo-1,3-dibutyl-pyrimidine-2,4-quinone > InChI=1S/C26H37BrN7O4/c1-5-7-11-32-23(21(27)24(35)33(26(32)36)12-8-6-2)34(13-9-29-10-14-34)25-30-18-16-20(38-4)19(37-3)15-17(18)22(28)31-25/h15-16,29H,5-14H2,1-4H3,(H2,28,30,31)/q+1 > PXIIKYWFGUNKEQ-UHFFFAOYSA-N > 3.4 > 590.20904 > C26H37BrN7O4+ > 591.5 > CCCCN1C(=C(C(=O)N(C1=O)CCCC)Br)[N+]2(CCNCC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC > CCCCN1C(=C(C(=O)N(C1=O)CCCC)Br)[N+]2(CCNCC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC > 123 > 590.20904 > 1 > 38 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 18 8 10 25 8 11 18 8 11 26 8 15 19 8 19 22 8 25 27 8 25 30 8 26 27 8 27 31 8 30 34 8 31 35 8 34 35 8 8 15 8 8 21 8 9 21 8 9 22 8 $$$$