71604296 -OEChem-04262404492D 61 63 0 0 0 0 0 0 0999 V2000 4.9298 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5637 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9298 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1618 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5294 7.4860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2615 7.4860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1275 8.9860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1993 5.9860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0948 4.9915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1166 4.7836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1275 5.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9935 6.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9935 7.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1275 4.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2615 6.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8595 5.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1275 7.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8595 7.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3954 7.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6634 7.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7256 6.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7256 7.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3954 8.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7974 7.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2615 9.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7974 6.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 7.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0653 6.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5294 9.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 5.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0653 7.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2857 6.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 5.6496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4298 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5906 5.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5075 4.9860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1275 4.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7475 4.9860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5715 7.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7245 6.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9515 5.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8595 5.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8595 8.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0619 8.4610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2648 8.4610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2625 6.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2625 7.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5294 6.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2615 10.1060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3343 6.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 8.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8394 10.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9925 9.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2194 8.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 5.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5284 7.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1568 6.9992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.7144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6988 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 35 1 0 0 0 0 3 35 1 0 0 0 0 4 36 1 0 0 0 0 4 61 1 0 0 0 0 5 36 2 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 50 1 0 0 0 0 7 18 1 0 0 0 0 7 20 2 0 0 0 0 8 18 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 22 1 0 0 0 0 17 44 1 0 0 0 0 19 23 1 0 0 0 0 19 45 1 0 0 0 0 20 24 1 0 0 0 0 21 25 1 0 0 0 0 21 46 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 26 2 0 0 0 0 24 30 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 26 51 1 0 0 0 0 27 31 1 0 0 0 0 27 52 1 0 0 0 0 28 32 2 0 0 0 0 28 53 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 35 36 1 0 0 0 0 M END > 71604296 > 1 > 575 > 10 > 2 > 6 > AAADceB7sYAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB9AAAHwAYCAAADQjBmxQ/+JbIEgCqAjb3bACChC0xkqAZ2KA4dJiIaOLA2dGUJAhogALIyCcQgMAOiAAAAAAQAAAQAAAAACAAAAAAAAAAAA== > 2-(2-isopropylphenyl)-5-methyl-N-[[4-(triazol-1-yl)phenyl]methyl]pyrimidin-4-amine;2,2,2-trifluoroacetic acid > 5-methyl-2-(2-propan-2-ylphenyl)-N-[[4-(1-triazolyl)phenyl]methyl]-4-pyrimidinamine;2,2,2-trifluoroacetic acid > 5-methyl-2-(2-propan-2-ylphenyl)-N-[[4-(triazol-1-yl)phenyl]methyl]pyrimidin-4-amine;2,2,2-trifluoroacetic acid > 5-methyl-2-(2-propan-2-ylphenyl)-N-[[4-(triazol-1-yl)phenyl]methyl]pyrimidin-4-amine;2,2,2-trifluoroacetic acid > 5-methyl-2-(2-propan-2-ylphenyl)-N-[[4-(1,2,3-triazol-1-yl)phenyl]methyl]pyrimidin-4-amine;2,2,2-tris(fluoranyl)ethanoic acid > (5-methyl-2-o-cumenyl-pyrimidin-4-yl)-[4-(triazol-1-yl)benzyl]amine;2,2,2-trifluoroacetic acid > InChI=1S/C23H24N6.C2HF3O2/c1-16(2)20-6-4-5-7-21(20)23-24-14-17(3)22(27-23)25-15-18-8-10-19(11-9-18)29-13-12-26-28-29;3-2(4,5)1(6)7/h4-14,16H,15H2,1-3H3,(H,24,25,27);(H,6,7) > IYBAXDDNZYZCRU-UHFFFAOYSA-N > 498.19910855 > C25H25F3N6O2 > 498.5 > CC1=CN=C(N=C1NCC2=CC=C(C=C2)N3C=CN=N3)C4=CC=CC=C4C(C)C.C(=O)(C(F)(F)F)O > CC1=CN=C(N=C1NCC2=CC=C(C=C2)N3C=CN=N3)C4=CC=CC=C4C(C)C.C(=O)(C(F)(F)F)O > 106 > 498.19910855 > 0 > 36 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 10 11 8 11 34 8 13 14 8 13 17 8 14 19 8 17 22 8 19 23 8 20 24 8 22 23 8 24 26 8 25 27 8 25 28 8 27 31 8 28 32 8 29 31 8 29 32 8 33 34 8 7 18 8 7 20 8 8 18 8 8 26 8 9 10 8 9 33 8 $$$$