53245633 -OEChem-04242403502D 67 70 0 0 0 0 0 0 0999 V2000 4.5321 -3.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5321 -3.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 3.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 0.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7966 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9996 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.0954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 4.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 3.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1957 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9928 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8588 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0617 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9278 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7248 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7483 1.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5953 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3683 2.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 37 1 0 0 0 0 3 37 1 0 0 0 0 4 14 2 0 0 0 0 5 17 2 0 0 0 0 6 34 2 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 62 1 0 0 0 0 11 15 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 17 1 0 0 0 0 13 21 2 0 0 0 0 15 18 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 20 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 24 2 0 0 0 0 18 25 1 0 0 0 0 19 22 1 0 0 0 0 19 46 1 0 0 0 0 20 26 2 0 0 0 0 20 27 1 0 0 0 0 21 23 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 31 1 0 0 0 0 24 50 1 0 0 0 0 25 32 2 0 0 0 0 25 51 1 0 0 0 0 26 29 1 0 0 0 0 26 52 1 0 0 0 0 27 30 2 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 28 34 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 33 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 37 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 38 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 M END > 53245633 > 1 > 838 > 7 > 1 > 10 > AAADceB7OYAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAACxUAAAHwAQAAAADAjhmBYzwIPABACIAiVSUACCAAAlAgAIiIEIZMiIIDrA1ZGEIYhqlyLIyecYiMCOQAAAAAACAACAAAAAAAQAAAAAAAAAAA== > 4-[[2,4-dioxo-1-[2-[4-(trifluoromethyl)phenyl]ethyl]quinazolin-3-yl]methyl]-N-(3-methoxypropyl)benzamide > 4-[[2,4-dioxo-1-[2-[4-(trifluoromethyl)phenyl]ethyl]-3-quinazolinyl]methyl]-N-(3-methoxypropyl)benzamide > 4-[[2,4-dioxo-1-[2-[4-(trifluoromethyl)phenyl]ethyl]quinazolin-3-yl]methyl]-N-(3-methoxypropyl)benzamide > 4-[[2,4-dioxo-1-[2-[4-(trifluoromethyl)phenyl]ethyl]quinazolin-3-yl]methyl]-N-(3-methoxypropyl)benzamide > 4-[[2,4-bis(oxidanylidene)-1-[2-[4-(trifluoromethyl)phenyl]ethyl]quinazolin-3-yl]methyl]-N-(3-methoxypropyl)benzamide > 4-[[2,4-diketo-1-[2-[4-(trifluoromethyl)phenyl]ethyl]quinazolin-3-yl]methyl]-N-(3-methoxypropyl)benzamide > InChI=1S/C29H28F3N3O4/c1-39-18-4-16-33-26(36)22-11-7-21(8-12-22)19-35-27(37)24-5-2-3-6-25(24)34(28(35)38)17-15-20-9-13-23(14-10-20)29(30,31)32/h2-3,5-14H,4,15-19H2,1H3,(H,33,36) > GAWGJEQVCRNMFZ-UHFFFAOYSA-N > 4.6 > 539.20319087 > C29H28F3N3O4 > 539.5 > COCCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N(C2=O)CCC4=CC=C(C=C4)C(F)(F)F > COCCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N(C2=O)CCC4=CC=C(C=C4)C(F)(F)F > 79 > 539.20319087 > 0 > 39 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 13 8 12 19 8 13 17 8 13 21 8 18 24 8 18 25 8 19 22 8 20 26 8 20 27 8 21 23 8 22 23 8 24 31 8 25 32 8 26 29 8 27 30 8 28 29 8 28 30 8 31 33 8 32 33 8 8 12 8 8 14 8 9 14 8 9 17 8 $$$$