46324782 -OEChem-03282404132D 62 65 0 1 0 0 0 0 0999 V2000 10.6693 -3.5857 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.5021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.0021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 2.5021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.4979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 4.5021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -1.9979 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7263 -1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 3.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -1.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -2.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 4.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 1.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 2.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 2.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 3.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 4.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 4.5367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 4.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0512 -3.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 4.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3602 -4.5367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3603 -4.5367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -1.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1248 -1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3278 -1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 1.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.9195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1938 -2.4729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9908 -2.4729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 -1.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 1.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 5.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8592 -0.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7683 -2.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9953 -1.1879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1483 -0.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6651 1.3121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4616 -3.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 3.0137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.1659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 1.9422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 5.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 4.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 3.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5722 3.9652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 4.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9522 5.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9958 -5.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7247 -5.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 33 1 0 0 0 0 2 17 2 0 0 0 0 3 21 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 17 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 41 1 0 0 0 0 6 13 1 0 0 0 0 6 22 2 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 34 1 0 0 0 0 8 11 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 14 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 25 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 28 2 0 0 0 0 13 19 1 0 0 0 0 14 23 2 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 20 27 1 0 0 0 0 22 31 1 0 0 0 0 23 26 1 0 0 0 0 23 44 1 0 0 0 0 24 27 2 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 32 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M END > 46324782 > 1 > 733 > 4 > 1 > 7 > AAADceB7MABAAAAAAAAAAAAAAAAAASAAAAAwYIAAAAAAAACB0AAAHgQQAAAADCjF2ASywYPAAAisAyVyVACDAIAlChBIiJkYdMgIYDLglZGUIQhglgDoyYcYiICOyAAAQAAQACCQAACAACAAQAAAAAAAAA== > N-[1-(2-thienyl)butyl]-4-[(3,6,7-trimethyl-2-oxo-quinoxalin-1-yl)methyl]benzamide > N-(1-thiophen-2-ylbutyl)-4-[(3,6,7-trimethyl-2-oxo-1-quinoxalinyl)methyl]benzamide > N-(1-thiophen-2-ylbutyl)-4-[(3,6,7-trimethyl-2-oxoquinoxalin-1-yl)methyl]benzamide > N-(1-thiophen-2-ylbutyl)-4-[(3,6,7-trimethyl-2-oxoquinoxalin-1-yl)methyl]benzamide > N-(1-thiophen-2-ylbutyl)-4-[(3,6,7-trimethyl-2-oxidanylidene-quinoxalin-1-yl)methyl]benzamide > 4-[(2-keto-3,6,7-trimethyl-quinoxalin-1-yl)methyl]-N-[1-(2-thienyl)butyl]benzamide > InChI=1S/C27H29N3O2S/c1-5-7-22(25-8-6-13-33-25)29-26(31)21-11-9-20(10-12-21)16-30-24-15-18(3)17(2)14-23(24)28-19(4)27(30)32/h6,8-15,22H,5,7,16H2,1-4H3,(H,29,31) > KCSVKMALYIGXJW-UHFFFAOYSA-N > 4.9 > 459.19804835 > C27H29N3O2S > 459.6 > CCCC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=C(C(=C4)C)C)N=C(C3=O)C > CCCC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=C(C(=C4)C)C)N=C(C3=O)C > 90 > 459.19804835 > 0 > 33 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 12 8 1 33 8 12 28 8 13 19 8 14 23 8 14 24 8 15 16 8 16 18 8 17 22 8 18 19 8 20 26 8 20 27 8 23 26 8 24 27 8 28 32 8 32 33 8 4 17 8 4 9 8 6 13 8 6 22 8 7 8 3 9 13 8 9 15 8 $$$$