67827152 -OEChem-05072422402D 64 67 0 1 0 0 0 0 0999 V2000 4.6660 -3.0021 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1923 0.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.4979 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6660 -1.0021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 -1.4746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 2.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 2.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 1.1889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.0021 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1058 1.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -0.9674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.9674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -1.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 -0.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7961 -1.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6602 -0.9646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7352 0.8813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4065 1.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 2.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9246 2.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -0.0847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6754 2.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 2.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7149 3.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8852 3.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3604 0.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 0.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 -0.3121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5207 2.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6451 2.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 1.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8421 -0.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -0.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -3.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0665 -2.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3249 -0.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5278 -0.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3995 -1.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1965 -1.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9723 -1.5003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1960 -0.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3482 -0.4289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 27 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 57 1 0 0 0 0 6 9 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 10 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 12 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 13 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 14 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 16 20 2 0 0 0 0 17 21 1 0 0 0 0 18 23 2 0 0 0 0 19 22 2 0 0 0 0 19 50 1 0 0 0 0 20 24 1 0 0 0 0 20 51 1 0 0 0 0 21 25 2 0 0 0 0 21 52 1 0 0 0 0 22 25 1 0 0 0 0 22 27 1 0 0 0 0 23 26 1 0 0 0 0 23 53 1 0 0 0 0 24 26 2 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 M CHG 1 3 1 M END > 67827152 > 1 > 579 > 3 > 1 > 7 > AAADcfB7IABAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAACxQAAAHgQQAAAADCjB2AQywYPAAAiIAiVSUACCAAAlChAIiJ0IZMgIYHLglZGUIQhglgDoyYcciACOEAAAQAAAAQAgAACAAAACAAAAAAAAAA== > 10-[2-(1-ethylpyrrolidin-1-ium-1-yl)-1-methyl-ethyl]-N-propyl-phenothiazine-2-carboxamide > 10-[1-(1-ethyl-1-pyrrolidin-1-iumyl)propan-2-yl]-N-propyl-2-phenothiazinecarboxamide > 10-[1-(1-ethylpyrrolidin-1-ium-1-yl)propan-2-yl]-N-propylphenothiazine-2-carboxamide > 10-[1-(1-ethylpyrrolidin-1-ium-1-yl)propan-2-yl]-N-propylphenothiazine-2-carboxamide > 10-[1-(1-ethylpyrrolidin-1-ium-1-yl)propan-2-yl]-N-propyl-phenothiazine-2-carboxamide > 10-[2-(1-ethylpyrrolidin-1-ium-1-yl)-1-methyl-ethyl]-N-propyl-phenothiazine-2-carboxamide > InChI=1S/C25H33N3OS/c1-4-14-26-25(29)20-12-13-24-22(17-20)27(21-10-6-7-11-23(21)30-24)19(3)18-28(5-2)15-8-9-16-28/h6-7,10-13,17,19H,4-5,8-9,14-16,18H2,1-3H3/p+1 > HMUFRBFGTDFCFU-UHFFFAOYSA-O > 5.3 > 424.24225889 > C25H34N3OS+ > 424.6 > CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)C[N+]4(CCCC4)CC > CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)C[N+]4(CCCC4)CC > 57.6 > 424.24225889 > 1 > 30 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 14 3 15 17 8 15 19 8 16 18 8 16 20 8 17 21 8 18 23 8 19 22 8 20 24 8 21 25 8 22 25 8 23 26 8 24 26 8 $$$$