54703803 -OEChem-04262410002D 63 66 0 1 0 0 0 0 0999 V2000 2.8660 -1.8988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8418 -2.9920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.1012 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0327 -4.3933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0109 -4.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -3.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 1.0186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 1.7089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 1.7089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 1.0186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 2.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 3.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 3.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 2.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 3.9936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 4.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 5.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 4.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 4.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -2.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -3.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -2.4357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -1.3618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5720 -4.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 -5.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1275 -3.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.8618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 32 1 0 0 0 0 2 17 1 0 0 0 0 2 57 1 0 0 0 0 3 16 2 0 0 0 0 4 28 1 0 0 0 0 4 31 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 16 1 0 0 0 0 7 21 1 0 0 0 0 7 23 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 33 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 16 1 0 0 0 0 13 17 2 0 0 0 0 14 18 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 17 22 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 24 1 0 0 0 0 19 47 1 0 0 0 0 20 25 2 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 49 1 0 0 0 0 23 28 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 26 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 M END > 54703803 > 1 > 724 > 6 > 1 > 7 > AAADceB7MABAAAAAAAAAAAAAAAAAASAAAAA8QIAAAAAAAAABwAAAHgQACAAADCzh2AayBYMABkiIAq1S0ACCCAAkKhAIiBmODMgOZjqk9TuXOSjkxhGYuYeYmYKOEAAAAAAAAAAgAAAAAAAAAAAAAAAAAA== > 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-(2-furylmethyl)-4-hydroxy-6-methyl-pyridin-2-one > 3-[(4-ethyl-1-piperazinyl)-[4-(methylthio)phenyl]methyl]-1-(2-furanylmethyl)-4-hydroxy-6-methyl-2-pyridinone > 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-(furan-2-ylmethyl)-4-hydroxy-6-methylpyridin-2-one > 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-(furan-2-ylmethyl)-4-hydroxy-6-methylpyridin-2-one > 3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-(furan-2-ylmethyl)-6-methyl-4-oxidanyl-pyridin-2-one > 3-[(4-ethylpiperazino)-[4-(methylthio)phenyl]methyl]-1-(2-furfuryl)-4-hydroxy-6-methyl-2-pyridone > InChI=1S/C25H31N3O3S/c1-4-26-11-13-27(14-12-26)24(19-7-9-21(32-3)10-8-19)23-22(29)16-18(2)28(25(23)30)17-20-6-5-15-31-20/h5-10,15-16,24,29H,4,11-14,17H2,1-3H3 > ULWDSLASSOBYLY-UHFFFAOYSA-N > 3 > 453.20861303 > C25H31N3O3S > 453.6 > CCN1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(C=C(N(C3=O)CC4=CC=CO4)C)O > CCN1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(C=C(N(C3=O)CC4=CC=CO4)C)O > 85.5 > 453.20861303 > 0 > 32 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 16 8 13 17 8 15 19 8 15 20 8 17 22 8 19 24 8 20 25 8 21 22 8 24 26 8 25 26 8 28 29 8 29 30 8 30 31 8 4 28 8 4 31 8 7 16 8 7 21 8 8 15 3 $$$$