51626003 -OEChem-04182406212D 65 68 0 1 0 0 0 0 0999 V2000 4.5981 -3.9426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.9426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3892 5.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 0.5519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 -0.8494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 0.7598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.1062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9426 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 1.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5575 1.2210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7654 2.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0223 2.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7165 2.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2302 3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 3.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1813 4.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3402 5.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -1.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.0252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9827 1.4533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 0.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.7526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4326 2.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1773 2.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7695 4.2613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5141 3.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -4.9426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 -4.9426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -5.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -5.7526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 -4.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5318 4.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9299 5.6342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1486 6.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 30 1 0 0 0 0 2 24 1 0 0 0 0 2 32 1 0 0 0 0 3 31 1 0 0 0 0 3 33 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 12 4 1 1 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 21 1 0 0 0 0 7 9 1 0 0 0 0 7 17 2 0 0 0 0 8 9 2 0 0 0 0 10 13 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 14 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 22 1 0 0 0 0 19 48 1 0 0 0 0 20 23 2 0 0 0 0 20 49 1 0 0 0 0 21 25 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 31 2 0 0 0 0 28 55 1 0 0 0 0 29 31 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 M END > 51626003 > 1 > 570 > 8 > 0 > 9 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHgAIAAAADCzBmwYzFocIBACiAiJiJACCCAMgoIAdyAA+jIiNZiKEuRuUMCpkwBOKqAew0LMOIAABAAAAQABAAAIAAACAAAAAAAAAAA== > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-ethyl-piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]-5-tetrazolyl]methyl]-4-ethylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-ethylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-ethylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-ethyl-piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-(1-p-anisyltetrazol-5-yl)methyl]-4-ethyl-piperazine > InChI=1S/C24H32N6O3/c1-5-28-12-14-29(15-13-28)23(19-8-11-21(32-3)22(16-19)33-4)24-25-26-27-30(24)17-18-6-9-20(31-2)10-7-18/h6-11,16,23H,5,12-15,17H2,1-4H3/t23-/m1/s1 > HGQMGRPORWKAQA-HSZRJFAPSA-N > 2.8 > 452.25358890 > C24H32N6O3 > 452.5 > CCN1CCN(CC1)C(C2=CC(=C(C=C2)OC)OC)C3=NN=NN3CC4=CC=C(C=C4)OC > CCN1CCN(CC1)[C@H](C2=CC(=C(C=C2)OC)OC)C3=NN=NN3CC4=CC=C(C=C4)OC > 77.8 > 452.25358890 > 0 > 33 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 16 19 8 16 20 8 19 22 8 20 23 8 22 24 8 23 24 8 25 26 8 25 27 8 26 28 8 27 29 8 28 31 8 29 31 8 12 4 5 6 17 8 6 8 8 7 17 8 7 9 8 8 9 8 $$$$