60193596 -OEChem-04192407322D 73 78 0 1 0 0 0 0 0999 V2000 9.0422 -2.8020 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 3.7912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.1576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.7912 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.2626 -1.7088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 2.0960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -4.2033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.2912 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3966 1.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 2.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -1.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -1.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 0.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9652 0.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7742 2.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 1.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 3.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9433 0.5888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4433 1.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1397 3.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 1.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 0.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -3.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7113 -3.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2113 -4.4112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 0.2086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.8989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1845 0.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -0.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 -0.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 0.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3932 2.7662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5961 2.7662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8931 2.4104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -1.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1845 -1.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -1.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 -1.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3452 0.7967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9004 0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2758 2.5624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4642 2.7349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 3.8738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 3.1836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7517 -0.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5097 0.3366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9449 1.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8582 1.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 -3.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -0.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 3.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 3.6358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5504 2.8539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.1479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 4.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3279 -3.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4634 -4.9776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.4991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.3192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.0088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 23 1 0 0 0 0 2 68 1 0 0 0 0 3 31 1 0 0 0 0 3 35 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 5 26 1 0 0 0 0 6 14 1 0 0 0 0 6 22 1 0 0 0 0 6 28 1 0 0 0 0 7 32 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 14 2 0 0 0 0 10 19 1 0 0 0 0 11 17 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 18 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 6 0 0 0 13 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 22 2 0 0 0 0 19 27 1 0 0 0 0 20 24 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 25 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 29 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 32 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 30 2 0 0 0 0 27 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 31 2 0 0 0 0 29 66 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 33 34 2 0 0 0 0 33 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 M END > 60193596 > 1 > 713 > 6 > 1 > 6 > AAADcfB7sABAAAAAAAAAAAAAAAAAAeLEAAA8WIAAAAAAAFgB/AAAHgQACAAADyzl3ga+x/MMFgikAzRnRACC+KBxKjhI2Cw+bJgOduLEsZuUcChmwBn46AeQ0PMPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(thiazol-2-ylmethyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1-yl]methanol > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(1,3-thiazol-2-ylmethyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1-yl]methanol > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(1,3-thiazol-2-ylmethyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1-yl]methanol > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(1,3-thiazol-2-ylmethyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1-yl]methanol > [(1R)-2-(cyclopentylmethyl)-7-methoxy-9-methyl-1'-(thiazol-2-ylmethyl)spiro[1,3-dihydro-beta-carboline-4,4'-piperidine]-1-yl]methanol > InChI=1S/C28H38N4O2S/c1-30-23-15-21(34-2)7-8-22(23)26-27(30)24(18-33)32(16-20-5-3-4-6-20)19-28(26)9-12-31(13-10-28)17-25-29-11-14-35-25/h7-8,11,14-15,20,24,33H,3-6,9-10,12-13,16-19H2,1-2H3/t24-/m0/s1 > KSEGILOBEBAIRZ-DEOSSOPVSA-N > 3.9 > 494.27154764 > C28H38N4O2S > 494.7 > CN1C2=C(C=CC(=C2)OC)C3=C1C(N(CC34CCN(CC4)CC5=NC=CS5)CC6CCCC6)CO > CN1C2=C(C=CC(=C2)OC)C3=C1[C@@H](N(CC34CCN(CC4)CC5=NC=CS5)CC6CCCC6)CO > 82 > 494.27154764 > 0 > 35 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 32 8 1 33 8 10 14 8 10 19 8 13 23 6 19 22 8 19 27 8 22 29 8 27 30 8 29 31 8 30 31 8 33 34 8 6 14 8 6 22 8 7 32 8 7 34 8 $$$$