16187406 -OEChem-03282421252D 57 59 0 1 0 0 0 0 0999 V2000 4.2609 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5658 2.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0678 6.8832 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.7134 6.4765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9044 7.8778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3825 7.2197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8825 8.0857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9338 6.3832 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2433 5.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0678 7.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2018 6.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7998 6.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2018 8.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3358 6.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3358 7.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0914 6.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5919 5.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7732 4.7804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3953 5.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 6.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 8.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9743 5.6889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2346 4.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 5.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 6.8624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 7.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8926 3.7378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 4.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9079 3.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9338 7.0032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6784 7.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2798 8.4659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 5.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6003 5.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6003 8.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 8.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4731 6.6470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6765 6.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2474 4.4519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1018 4.2546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 5.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 5.6243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8695 4.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7238 4.5728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 5.7286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 9.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6832 5.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5217 5.3978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2654 6.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8452 4.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2085 5.7448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.5504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.2161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2911 3.2629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6544 4.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9552 2.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2609 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 57 1 0 0 0 0 2 29 1 0 0 0 0 2 56 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 7 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 8 30 1 0 0 0 0 9 16 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 21 2 0 0 0 0 16 22 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 23 2 0 0 0 0 17 24 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 25 1 0 0 0 0 20 45 1 0 0 0 0 21 26 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 27 1 0 0 0 0 23 50 1 0 0 0 0 24 28 2 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 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 29 1 0 0 0 0 28 55 1 0 0 0 0 M END > 16187406 > 1 > 507 > 5 > 2 > 5 > AAADceB7oAAEAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAACx0AAAHgAICAAADKzBmwQzFocIAgCiAiJiJACCAAMgIIAdiAA+DIiIZiKCmROUcAhkwBOImAeQ0IMOoAAAAAAQAABAAAAAACAAAAAAAAAAAA== > 4-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(1,1-dimethylpropyl)tetrazol-5-yl]methyl]phenol;hydrochloride > 4-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl]phenol;hydrochloride > 4-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]phenol;hydrochloride > 4-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]phenol;hydrochloride > 4-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]methyl]phenol;hydrochloride > 4-[(1-tert-amyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenol;hydrochloride > InChI=1S/C22H27N5O.ClH/c1-4-22(2,3)27-21(23-24-25-27)20(17-9-11-19(28)12-10-17)26-14-13-16-7-5-6-8-18(16)15-26;/h5-12,20,28H,4,13-15H2,1-3H3;1H > VLIWPFUHSAHGRO-UHFFFAOYSA-N > 413.1982382 > C22H28ClN5O > 413.9 > CCC(C)(C)N1C(=NN=N1)C(C2=CC=C(C=C2)O)N3CCC4=CC=CC=C4C3.Cl > CCC(C)(C)N1C(=NN=N1)C(C2=CC=C(C=C2)O)N3CCC4=CC=CC=C4C3.Cl > 67.1 > 413.1982382 > 0 > 29 > 0 > 1 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 14 15 8 14 20 8 15 21 8 17 23 8 17 24 8 20 25 8 21 26 8 23 27 8 24 28 8 25 26 8 27 29 8 28 29 8 4 12 8 4 6 8 5 12 8 5 7 8 6 7 8 8 17 3 $$$$