58538937 -OEChem-04252405492D 65 68 0 1 0 0 0 0 0999 V2000 11.5980 2.0188 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0718 -1.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 0.0188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 0.4779 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.2000 0.4913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5980 0.0188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 2.0188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4779 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8641 1.9746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 0.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 1.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6038 -0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4679 0.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 2.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3359 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0679 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7320 0.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8381 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 1.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7320 1.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5980 -0.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8381 2.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 0.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 -1.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 1.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 -0.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 -2.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1961 -1.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 -2.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1961 -2.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2702 1.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2608 2.4510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4637 2.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4751 -0.5019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2722 -0.4988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7857 2.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3898 1.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3929 0.5766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8104 1.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2063 2.0913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2071 -0.4952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -0.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8646 0.9611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0676 0.9580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2123 2.9836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5899 3.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9723 2.9788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9392 -0.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7362 -0.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1976 1.1113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8452 -0.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3963 1.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9875 -0.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3860 -1.5638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8452 2.6734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 -0.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9271 -2.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7331 -1.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 -3.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7331 -2.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 2.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 28 1 0 0 0 0 2 18 2 0 0 0 0 3 26 2 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 5 54 1 0 0 0 0 6 20 1 0 0 0 0 6 24 1 0 0 0 0 6 26 1 0 0 0 0 7 28 2 0 0 0 0 7 65 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 17 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 55 1 0 0 0 0 22 25 2 0 0 0 0 22 56 1 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 29 31 1 0 0 0 0 29 60 1 0 0 0 0 30 32 2 0 0 0 0 30 61 1 0 0 0 0 31 33 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 M END > 58538937 > 1 > 696 > 5 > 2 > 8 > AAADcfB7sABAAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAACxQAAAHgQQAAAADCjB2AQywYPAAAioAiVyUACCAgAlChAIiJ0IZMgIIDLg1ZGEIQhglgDoyYcciACOEAAAQAAAAQAgAACAAAACAAAAAAAAAA== > 4-benzyl-N-[3-(2-ethyl-1-piperidyl)propyl]-2-imino-3-oxo-1,4-benzothiazine-6-carboxamide > N-[3-(2-ethyl-1-piperidinyl)propyl]-2-imino-3-oxo-4-(phenylmethyl)-1,4-benzothiazine-6-carboxamide > 4-benzyl-N-[3-(2-ethylpiperidin-1-yl)propyl]-2-imino-3-oxo-1,4-benzothiazine-6-carboxamide > 4-benzyl-N-[3-(2-ethylpiperidin-1-yl)propyl]-2-imino-3-oxo-1,4-benzothiazine-6-carboxamide > 2-azanylidene-N-[3-(2-ethylpiperidin-1-yl)propyl]-3-oxidanylidene-4-(phenylmethyl)-1,4-benzothiazine-6-carboxamide > 4-benzyl-N-[3-(2-ethylpiperidino)propyl]-2-imino-3-keto-1,4-benzothiazine-6-carboxamide > InChI=1S/C26H32N4O2S/c1-2-21-11-6-7-15-29(21)16-8-14-28-25(31)20-12-13-23-22(17-20)30(26(32)24(27)33-23)18-19-9-4-3-5-10-19/h3-5,9-10,12-13,17,21,27H,2,6-8,11,14-16,18H2,1H3,(H,28,31) > CPMQVKHRKXYPMD-UHFFFAOYSA-N > 4.8 > 464.22459745 > C26H32N4O2S > 464.6 > CCC1CCCCN1CCCNC(=O)C2=CC3=C(C=C2)SC(=N)C(=O)N3CC4=CC=CC=C4 > CCC1CCCCN1CCCNC(=O)C2=CC3=C(C=C2)SC(=N)C(=O)N3CC4=CC=CC=C4 > 102 > 464.22459745 > 0 > 33 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 23 8 1 28 8 19 21 8 19 22 8 20 21 8 20 23 8 22 25 8 23 25 8 26 28 8 27 29 8 27 30 8 29 31 8 30 32 8 31 33 8 32 33 8 6 20 8 6 26 8 8 13 3 $$$$