51625639 -OEChem-04262401272D 70 73 0 1 0 0 0 0 0999 V2000 4.5981 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 -0.1567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 1.2445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 1.4524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5220 -0.2308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 -1.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0357 -1.5690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4730 -0.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8130 0.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0334 0.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9872 -2.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8628 -2.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9087 -1.2282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6208 -1.1083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 -1.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4506 -2.0298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2814 -1.1294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0627 -0.7314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6646 0.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -5.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 -4.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 33 1 0 0 0 0 2 27 1 0 0 0 0 2 34 1 0 0 0 0 9 3 1 1 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 5 7 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 15 2 0 0 0 0 7 8 2 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 35 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 16 21 2 0 0 0 0 16 23 1 0 0 0 0 17 22 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 24 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 25 1 0 0 0 0 21 54 1 0 0 0 0 22 28 2 0 0 0 0 22 29 1 0 0 0 0 23 26 2 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 28 30 1 0 0 0 0 28 60 1 0 0 0 0 29 31 2 0 0 0 0 29 61 1 0 0 0 0 30 32 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 M END > 51625639 > 1 > 608 > 7 > 0 > 9 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHgAIAAAADKzBmwYzFocIBACiAiJiJACCCAMgIIAdiAA+jIiNZiKEuRuUMCpkwBOKqAew0LMOIAABAAAAQABAAAIAAACAAAAAAAAAAA== > 1-benzyl-4-[(R)-(3,4-dimethoxyphenyl)-[1-(1,1-dimethylpropyl)tetrazol-5-yl]methyl]piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl]-4-(phenylmethyl)piperazine > 1-benzyl-4-[(R)-(3,4-dimethoxyphenyl)-[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]piperazine > 1-benzyl-4-[(R)-(3,4-dimethoxyphenyl)-[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]methyl]-4-(phenylmethyl)piperazine > 1-[(R)-(1-tert-amyltetrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]-4-benzyl-piperazine > InChI=1S/C26H36N6O2/c1-6-26(2,3)32-25(27-28-29-32)24(21-12-13-22(33-4)23(18-21)34-5)31-16-14-30(15-17-31)19-20-10-8-7-9-11-20/h7-13,18,24H,6,14-17,19H2,1-5H3/t24-/m1/s1 > VVEUSJFOWNBBST-XMMPIXPASA-N > 3.8 > 464.28997441 > C26H36N6O2 > 464.6 > CCC(C)(C)N1C(=NN=N1)C(C2=CC(=C(C=C2)OC)OC)N3CCN(CC3)CC4=CC=CC=C4 > CCC(C)(C)N1C(=NN=N1)[C@@H](C2=CC(=C(C=C2)OC)OC)N3CCN(CC3)CC4=CC=CC=C4 > 68.5 > 464.28997441 > 0 > 34 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 16 21 8 16 23 8 21 25 8 22 28 8 22 29 8 23 26 8 25 27 8 26 27 8 28 30 8 29 31 8 9 3 5 30 32 8 31 32 8 5 15 8 5 7 8 6 15 8 6 8 8 7 8 8 $$$$