70677818 -OEChem-05112409462D 71 72 0 1 0 0 0 0 0999 V2000 4.0010 11.3831 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.7225 4.1925 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.7225 6.6909 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 0.1279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 7.3831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 3.8831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 5.8831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 2.3831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 0.8831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 7.3831 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.6793 2.6878 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7331 2.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2629 1.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6793 1.0784 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8671 2.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 4.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 4.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 5.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 3.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 7.3831 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8671 6.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 6.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 8.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 7.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 9.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 9.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 10.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2418 3.1272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7238 1.4684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7238 2.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2418 0.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 4.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 3.8005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9451 3.8005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3437 4.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 5.9657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 5.2754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3437 5.2754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9451 5.9657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5793 3.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1826 4.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4006 3.8310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 6.7631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 6.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 6.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5966 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 1.0731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.5031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 8.3831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 9.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 8.3831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 8.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 8.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 7.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.6931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 6.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 5.8831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 5.8831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 10.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 10.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7225 4.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7225 6.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 70 1 0 0 0 0 3 71 1 0 0 0 0 14 4 1 1 0 0 0 4 54 1 0 0 0 0 5 23 2 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 23 1 0 0 0 0 8 15 2 0 0 0 0 8 26 1 0 0 0 0 9 16 1 0 0 0 0 9 26 2 0 0 0 0 10 24 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 6 0 0 0 11 36 1 0 0 0 0 12 15 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 17 19 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 6 0 0 0 22 25 1 0 0 0 0 22 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 55 1 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 33 1 0 0 0 0 29 60 1 0 0 0 0 30 34 2 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 33 35 2 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 34 69 1 0 0 0 0 M END > 70677818 > 1 > 651 > 6 > 3 > 6 > AAADcfB7sAAGAAAAAAAAAAAAAAAAAYAAAAA8WIAAAAAAAFgBwAAAHgIACAAADT7hniY3sJcIEgCoAydzdASCgCkxBaAJ2CE4TpiKfjrB39GUdAhsxgPY2Ce4mMKOhAAAAAAAAAAIAAAAAAAAAKAACQgAAA== > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-[isopropyl(methyl)amino]propan-1-one;dihydrochloride > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1-piperazinyl]-3-[methyl(propan-2-yl)amino]-1-propanone;dihydrochloride > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-[methyl(propan-2-yl)amino]propan-1-one;dihydrochloride > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-[methyl(propan-2-yl)amino]propan-1-one;dihydrochloride > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-5-methyl-7-oxidanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-[methyl(propan-2-yl)amino]propan-1-one;dihydrochloride > (2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazino]-3-[isopropyl(methyl)amino]propan-1-one;dihydrochloride > InChI=1S/C25H34ClN5O2.2ClH/c1-16(2)29(4)14-20(18-5-7-19(26)8-6-18)25(33)31-11-9-30(10-12-31)24-22-17(3)13-21(32)23(22)27-15-28-24;;/h5-8,15-17,20-21,32H,9-14H2,1-4H3;2*1H/t17-,20-,21-;;/m1../s1 > UFUPUAUZUBGQBO-LZLFICJFSA-N > 543.193458 > C25H36Cl3N5O2 > 544.9 > CC1CC(C2=C1C(=NC=N2)N3CCN(CC3)C(=O)C(CN(C)C(C)C)C4=CC=C(C=C4)Cl)O.Cl.Cl > C[C@@H]1C[C@H](C2=C1C(=NC=N2)N3CCN(CC3)C(=O)[C@H](CN(C)C(C)C)C4=CC=C(C=C4)Cl)O.Cl.Cl > 72.8 > 543.193458 > 0 > 35 > 3 > 0 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 11 21 6 12 15 8 12 16 8 22 24 6 25 29 8 25 30 8 29 33 8 30 34 8 33 35 8 34 35 8 14 4 5 8 15 8 8 26 8 9 16 8 9 26 8 $$$$