53347899 -OEChem-05092415312D 69 70 0 1 0 0 0 0 0999 V2000 12.9199 4.5778 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5422 5.9845 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.3924 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 6.7584 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 5.0264 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1982 10.4187 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5643 11.7847 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5643 10.0527 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.9199 4.5778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9199 4.5778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1878 4.5778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7461 0.7211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.8924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7963 10.9187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9303 12.4187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9199 5.5778 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.3218 6.0778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7859 2.0778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3512 4.5832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0538 6.0778 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0538 7.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9199 7.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7859 6.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7859 7.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1878 5.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9199 3.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0538 3.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7859 3.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4558 5.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0538 2.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9199 1.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3731 4.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8731 5.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9664 3.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5541 2.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9718 3.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1474 1.7392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5651 2.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1529 1.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0643 10.9187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9303 11.4187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0538 5.4578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8418 7.6604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4433 6.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3184 8.0527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5213 8.0527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9979 5.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3965 6.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3965 6.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9979 7.6604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3218 6.6978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5169 3.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3228 3.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5169 1.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9199 0.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2565 5.3062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1707 2.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6074 3.8588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5118 1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9485 2.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6868 1.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8164 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 6.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3332 11.2287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 1 10 2 0 0 0 0 1 17 1 0 0 0 0 1 27 1 0 0 0 0 2 30 1 0 0 0 0 2 34 1 0 0 0 0 3 42 1 0 0 0 0 4 42 1 0 0 0 0 5 42 1 0 0 0 0 6 43 1 0 0 0 0 7 43 1 0 0 0 0 8 43 1 0 0 0 0 11 26 2 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 44 1 0 0 0 0 13 68 1 0 0 0 0 14 45 1 0 0 0 0 14 69 1 0 0 0 0 15 44 2 0 0 0 0 16 45 2 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 18 26 1 0 0 0 0 18 30 1 0 0 0 0 18 55 1 0 0 0 0 19 29 1 0 0 0 0 19 32 2 0 0 0 0 20 30 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 1 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 31 2 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 36 38 1 0 0 0 0 36 61 1 0 0 0 0 37 39 2 0 0 0 0 37 62 1 0 0 0 0 38 40 2 0 0 0 0 38 63 1 0 0 0 0 39 40 1 0 0 0 0 39 64 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 M END > 53347899 > 1 > 792 > 18 > 3 > 6 > AAADceB7vcBgAAAAAAAAAAAAAAAAAWAAAAA8WIAAAAAAAAAB8AAAHwQQSAAADCzF3ha/n5LIFgqsAzX3fHDC+LlxKjkJ2D2+bJiMZvLkubuUMChs0RPI6CeY2IMOIAAAAAAAAABAAAAAAAAAAAAAAAAAAA== > (2R)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-1-(3-pyridylsulfonyl)piperidine-2-carboxamide;2,2,2-trifluoroacetic acid > (2R)-N-[4-(4-methoxyphenyl)-2-thiazolyl]-1-(3-pyridinylsulfonyl)-2-piperidinecarboxamide;2,2,2-trifluoroacetic acid > (2R)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonylpiperidine-2-carboxamide;2,2,2-trifluoroacetic acid > (2R)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonylpiperidine-2-carboxamide;2,2,2-trifluoroacetic acid > (2R)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonyl-piperidine-2-carboxamide;2,2,2-tris(fluoranyl)ethanoic acid > (2R)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-1-(3-pyridylsulfonyl)pipecolinamide;2,2,2-trifluoroacetic acid > InChI=1S/C21H22N4O4S2.2C2HF3O2/c1-29-16-9-7-15(8-10-16)18-14-30-21(23-18)24-20(26)19-6-2-3-12-25(19)31(27,28)17-5-4-11-22-13-17;2*3-2(4,5)1(6)7/h4-5,7-11,13-14,19H,2-3,6,12H2,1H3,(H,23,24,26);2*(H,6,7)/t19-;;/m1../s1 > CPDVESDMOVAASK-JQDLGSOUSA-N > 686.09397506 > C25H24F6N4O8S2 > 686.6 > COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCCN3S(=O)(=O)C4=CN=CC=C4.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O > COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@H]3CCCCN3S(=O)(=O)C4=CN=CC=C4.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O > 213 > 686.09397506 > 0 > 45 > 1 > 0 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 19 29 8 19 32 8 2 30 8 2 34 8 20 30 8 20 33 8 21 26 5 27 28 8 27 29 8 28 31 8 31 32 8 33 34 8 35 36 8 35 37 8 36 38 8 37 39 8 38 40 8 39 40 8 $$$$