69950845 -OEChem-04162403592D 70 73 0 0 0 0 0 0 0999 V2000 13.8603 -3.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.8603 -2.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.8603 -1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.8603 -2.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8603 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.7321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.2679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -1.7680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3602 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8603 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3603 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3603 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3603 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 3.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 3.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 3.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8603 -2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8603 -2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.7679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -0.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 1.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.2562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 -1.7921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8853 0.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8853 -0.5325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4429 0.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7526 1.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2776 -1.2120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9679 -1.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8352 -0.5325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8352 0.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3928 1.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5957 1.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2632 1.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 1.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 1.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8636 1.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9429 -1.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2526 -1.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2632 3.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 3.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 4.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2776 -2.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9679 -3.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 1.8867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -1.4226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 -2.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9932 -2.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 2.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 2.8762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3839 2.2586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3839 -1.7945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 -2.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 -1.7897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 29 1 0 0 0 0 3 29 1 0 0 0 0 4 19 2 0 0 0 0 5 35 1 0 0 0 0 5 37 1 0 0 0 0 6 36 1 0 0 0 0 6 38 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 7 19 1 0 0 0 0 8 17 1 0 0 0 0 8 22 1 0 0 0 0 8 49 1 0 0 0 0 9 28 2 0 0 0 0 9 30 1 0 0 0 0 10 28 1 0 0 0 0 10 31 2 0 0 0 0 11 31 1 0 0 0 0 11 63 1 0 0 0 0 11 64 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 20 50 1 0 0 0 0 21 25 2 0 0 0 0 21 51 1 0 0 0 0 22 28 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 27 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 26 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 27 29 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 30 32 1 0 0 0 0 30 33 2 0 0 0 0 31 32 1 0 0 0 0 32 34 2 0 0 0 0 33 35 1 0 0 0 0 33 61 1 0 0 0 0 34 36 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 38 70 1 0 0 0 0 M END > 69950845 > 1 > 759 > 10 > 2 > 9 > AAADcfB7sYAAAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAACx9AAAHwAQAAAADgzBnxYz9vfIFACoAydydACCiCkhIqAJmKE+7JiNbrLE+duUNCpuxhvK6Cew0NMPoEABAgACQABAgAIEAASAAAAAAAAAAA== > 1-[4-[[(4-amino-6,7-dimethoxy-quinazolin-2-yl)methylamino]methyl]-4-phenyl-1-piperidyl]-4,4,4-trifluoro-butan-1-one > 1-[4-[[(4-amino-6,7-dimethoxy-2-quinazolinyl)methylamino]methyl]-4-phenyl-1-piperidinyl]-4,4,4-trifluoro-1-butanone > 1-[4-[[(4-amino-6,7-dimethoxyquinazolin-2-yl)methylamino]methyl]-4-phenylpiperidin-1-yl]-4,4,4-trifluorobutan-1-one > 1-[4-[[(4-amino-6,7-dimethoxyquinazolin-2-yl)methylamino]methyl]-4-phenylpiperidin-1-yl]-4,4,4-trifluorobutan-1-one > 1-[4-[[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)methylamino]methyl]-4-phenyl-piperidin-1-yl]-4,4,4-tris(fluoranyl)butan-1-one > 1-[4-[[(4-amino-6,7-dimethoxy-quinazolin-2-yl)methylamino]methyl]-4-phenyl-piperidino]-4,4,4-trifluoro-butan-1-one > InChI=1S/C27H32F3N5O3/c1-37-21-14-19-20(15-22(21)38-2)33-23(34-25(19)31)16-32-17-26(18-6-4-3-5-7-18)10-12-35(13-11-26)24(36)8-9-27(28,29)30/h3-7,14-15,32H,8-13,16-17H2,1-2H3,(H2,31,33,34) > ONHMOOVKCXOPTA-UHFFFAOYSA-N > 3.7 > 531.24572439 > C27H32F3N5O3 > 531.6 > COC1=C(C=C2C(=C1)C(=NC(=N2)CNCC3(CCN(CC3)C(=O)CCC(F)(F)F)C4=CC=CC=C4)N)OC > COC1=C(C=C2C(=C1)C(=NC(=N2)CNCC3(CCN(CC3)C(=O)CCC(F)(F)F)C4=CC=CC=C4)N)OC > 103 > 531.24572439 > 0 > 38 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 28 8 10 31 8 18 20 8 18 21 8 20 24 8 21 25 8 24 26 8 25 26 8 30 32 8 30 33 8 31 32 8 32 34 8 33 35 8 34 36 8 35 36 8 9 28 8 9 30 8 $$$$