51625383 -OEChem-05102420552D 62 65 0 1 0 0 0 0 0999 V2000 3.7320 -4.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5232 4.9536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4347 0.3718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 -1.0294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4128 0.5797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.2863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1227 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 0.8773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6915 1.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 2.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1563 2.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8505 2.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3642 3.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0584 3.3063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3152 3.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 5.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 0.2697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.9599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -1.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -1.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.3523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.3523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.2053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 1.2732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 0.5152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5666 2.4966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3112 1.9133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9034 4.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 3.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -5.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -5.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -6.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -5.0858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1949 6.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3193 6.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3652 5.1619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 30 1 0 0 0 0 2 23 1 0 0 0 0 2 31 1 0 0 0 0 3 29 1 0 0 0 0 3 32 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 17 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 16 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 15 1 0 0 0 0 12 16 1 0 0 0 0 12 33 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 21 1 0 0 0 0 18 45 1 0 0 0 0 19 22 2 0 0 0 0 19 46 1 0 0 0 0 20 24 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 50 1 0 0 0 0 26 28 2 0 0 0 0 26 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 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 31 58 1 0 0 0 0 31 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 M END > 51625383 > 1 > 556 > 8 > 0 > 8 > AAADceB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHgAIAAAADCzBmwYzFocIBACiAiJiJACCCAMgoIAdyAA+jIiNZiKEuRuUMCpkwBOKqAew0LMOIAABAAAAQABAAAIAAACAAAAAAAAAAA== > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-methyl-piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]-5-tetrazolyl]methyl]-4-methylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-methylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]methyl]-4-methylpiperazine > 1-[(R)-(3,4-dimethoxyphenyl)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-methyl-piperazine > 1-[(R)-(3,4-dimethoxyphenyl)-(1-p-anisyltetrazol-5-yl)methyl]-4-methyl-piperazine > InChI=1S/C23H30N6O3/c1-27-11-13-28(14-12-27)22(18-7-10-20(31-3)21(15-18)32-4)23-24-25-26-29(23)16-17-5-8-19(30-2)9-6-17/h5-10,15,22H,11-14,16H2,1-4H3/t22-/m1/s1 > FMUDZXWDQQNWFN-JOCHJYFZSA-N > 2.5 > 438.23793884 > C23H30N6O3 > 438.5 > CN1CCN(CC1)C(C2=CC(=C(C=C2)OC)OC)C3=NN=NN3CC4=CC=C(C=C4)OC > CN1CCN(CC1)[C@H](C2=CC(=C(C=C2)OC)OC)C3=NN=NN3CC4=CC=C(C=C4)OC > 77.8 > 438.23793884 > 0 > 32 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 15 18 8 15 19 8 18 21 8 19 22 8 21 23 8 22 23 8 24 25 8 24 26 8 25 27 8 26 28 8 27 29 8 28 29 8 12 4 5 6 16 8 6 8 8 7 16 8 7 9 8 8 9 8 $$$$