70436638 -OEChem-05062409422D 71 74 0 1 0 0 0 0 0999 V2000 10.7263 3.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 0.6550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5923 1.1550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7263 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3244 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -2.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.8658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 0.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 -3.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2632 0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1292 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1893 -0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9953 0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2029 2.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8044 2.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3233 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5267 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7297 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2063 -0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6048 -0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2823 -1.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1292 -1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9023 -0.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5502 -0.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3233 -1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1703 -1.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6344 0.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8613 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0144 1.6919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8383 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0783 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0501 1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6516 0.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7297 -1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5267 -1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 0.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -2.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9932 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 0.6768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 1.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3839 0.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3839 -3.3715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 -3.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 -3.3668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 31 1 0 0 0 0 2 33 1 0 0 0 0 3 32 1 0 0 0 0 3 34 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 25 2 0 0 0 0 6 26 1 0 0 0 0 7 25 1 0 0 0 0 7 27 2 0 0 0 0 8 27 1 0 0 0 0 8 64 1 0 0 0 0 8 65 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 35 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 36 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 37 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 12 38 1 0 0 0 0 13 15 2 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 17 23 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 24 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 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 60 1 0 0 0 0 24 61 1 0 0 0 0 26 28 1 0 0 0 0 26 29 2 0 0 0 0 27 28 1 0 0 0 0 28 30 2 0 0 0 0 29 31 1 0 0 0 0 29 62 1 0 0 0 0 30 32 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 34 71 1 0 0 0 0 M END > 70436638 > 1 > 736 > 8 > 1 > 6 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAAAAAAA8WIEAAAAAAACx8AAAHgAQAAAADQzBngYz9vdIFACoA6ZyZACCiCkhIqABmCE+7NiNbrLE+duUNCpuwBvK6We42VMOoEABAgACQABAgAIEAASAAAAAAAAAAA== > 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4,5-diisopropyl-cyclohex-2-en-1-one > 3-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-4,5-di(propan-2-yl)-1-cyclohex-2-enone > 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-4,5-di(propan-2-yl)cyclohex-2-en-1-one > 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-4,5-di(propan-2-yl)cyclohex-2-en-1-one > 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4,5-di(propan-2-yl)cyclohex-2-en-1-one > 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-4,5-diisopropyl-cyclohex-2-en-1-one > InChI=1S/C26H37N5O3/c1-15(2)18-11-17(32)12-21(24(18)16(3)4)30-7-9-31(10-8-30)26-28-20-14-23(34-6)22(33-5)13-19(20)25(27)29-26/h12-16,18,24H,7-11H2,1-6H3,(H2,27,28,29) > KLNGXYVEWPHTOF-UHFFFAOYSA-N > 4.2 > 467.28964006 > C26H37N5O3 > 467.6 > CC(C)C1CC(=O)C=C(C1C(C)C)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC > CC(C)C1CC(=O)C=C(C1C(C)C)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC > 93.8 > 467.28964006 > 0 > 34 > 0 > 2 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 3 26 28 8 26 29 8 27 28 8 28 30 8 29 31 8 30 32 8 31 32 8 6 25 8 6 26 8 7 25 8 7 27 8 9 11 3 $$$$