70458869 -OEChem-03282413242D 66 68 0 0 0 0 0 0 0999 V2000 2.8660 3.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 4.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 -4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2708 -3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8723 -2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -2.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -1.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -0.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 -0.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9893 -5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -6.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -4.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 6.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 6.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 28 1 0 0 0 0 1 31 1 0 0 0 0 2 21 2 0 0 0 0 5 32 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 8 29 1 0 0 0 0 8 32 1 0 0 0 0 8 60 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 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 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 21 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 22 1 0 0 0 0 19 52 1 0 0 0 0 20 23 2 0 0 0 0 20 53 1 0 0 0 0 21 24 1 0 0 0 0 22 25 2 0 0 0 0 22 54 1 0 0 0 0 23 25 1 0 0 0 0 23 55 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 56 1 0 0 0 0 26 29 1 0 0 0 0 26 57 1 0 0 0 0 27 30 2 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 59 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 M END > 70458869 > 1 > 737 > 6 > 1 > 10 > AAADcfB7OABAAAAAAAAAAAAAAAAAAAAAAAA8YIAAAAAAAAABQAAAHgQQAAAADAzB2ASywYPAAAqIAqVSUHDCAAAlChAIiB0IZMgIYDLglZGUIQhglADIyYcciMCOEAAAQAAAAQAgAACAAAACAAAAAAAAAA== > N-[2-methylsulfonyl-5-[6-(4-phenylpiperazin-1-yl)hexanoyl]phenyl]acetamide > N-[2-methylsulfonyl-5-[1-oxo-6-(4-phenyl-1-piperazinyl)hexyl]phenyl]acetamide > N-[2-methylsulfonyl-5-[6-(4-phenylpiperazin-1-yl)hexanoyl]phenyl]acetamide > N-[2-methylsulfonyl-5-[6-(4-phenylpiperazin-1-yl)hexanoyl]phenyl]acetamide > N-[2-methylsulfonyl-5-[6-(4-phenylpiperazin-1-yl)hexanoyl]phenyl]ethanamide > N-[2-mesyl-5-[6-(4-phenylpiperazino)hexanoyl]phenyl]acetamide > InChI=1S/C25H33N3O4S/c1-20(29)26-23-19-21(12-13-25(23)33(2,31)32)24(30)11-7-4-8-14-27-15-17-28(18-16-27)22-9-5-3-6-10-22/h3,5-6,9-10,12-13,19H,4,7-8,11,14-18H2,1-2H3,(H,26,29) > AUUSTAIZIZMYEO-UHFFFAOYSA-N > 3.2 > 471.21917772 > C25H33N3O4S > 471.6 > CC(=O)NC1=C(C=CC(=C1)C(=O)CCCCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C > CC(=O)NC1=C(C=CC(=C1)C(=O)CCCCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C > 95.2 > 471.21917772 > 0 > 33 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 16 19 8 16 20 8 19 22 8 20 23 8 22 25 8 23 25 8 24 26 8 24 27 8 26 29 8 27 30 8 28 29 8 28 30 8 $$$$