24232834 -OEChem-03182423002D 53 56 0 0 0 0 0 0 0999 V2000 8.8834 1.1252 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9003 -1.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.8693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2682 2.2467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3615 0.4671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -3.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -2.8638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -2.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2628 2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8615 1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8451 1.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8505 1.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6924 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6695 3.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2518 2.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6640 3.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4329 0.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 -3.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 -3.6614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 -1.7450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -2.5701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -3.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0982 -2.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -0.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 -1.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9162 -2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 -2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -3.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 -0.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -1.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.9893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -3.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9038 2.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5984 0.9758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3051 3.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8684 2.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9162 3.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9313 0.4733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7973 0.3361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9344 1.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 23 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 12 2 0 0 0 0 4 26 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 46 1 0 0 0 0 7 23 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 17 20 2 0 0 0 0 17 42 1 0 0 0 0 18 21 1 0 0 0 0 18 43 1 0 0 0 0 19 21 2 0 0 0 0 19 44 1 0 0 0 0 20 26 1 0 0 0 0 21 45 1 0 0 0 0 22 25 1 0 0 0 0 22 27 2 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 24 30 1 0 0 0 0 25 47 1 0 0 0 0 27 29 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END > 24232834 > 1 > 702 > 4 > 1 > 6 > AAADceB7MABAAAAAAAAAAAAAAAAAAWIAAAAwYAAAAAAAAAABQAAAHgQQAAAADAzh2AYzxoPABAioAiVSdAKCGAFhIhAJiABObMgOJiLEuZ+HOCjk1hHY6YeQwCAOAAAAQAAIAAAAAACAABAAAAAAAAAAAA== > (5E)-2-(3-methylanilino)-5-[[2-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]methylene]thiazol-4-one > (5E)-2-(3-methylanilino)-5-[[2-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]methylidene]-4-thiazolone > (5E)-2-(3-methylanilino)-5-[[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]methylidene]-1,3-thiazol-4-one > (5E)-2-(3-methylanilino)-5-[[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]methylidene]-1,3-thiazol-4-one > (5E)-2-[(3-methylphenyl)amino]-5-[[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]methylidene]-1,3-thiazol-4-one > (5E)-5-[2-(2-keto-2-pyrrolidino-ethoxy)benzylidene]-2-(m-toluidino)-2-thiazolin-4-one > InChI=1S/C23H23N3O3S/c1-16-7-6-9-18(13-16)24-23-25-22(28)20(30-23)14-17-8-2-3-10-19(17)29-15-21(27)26-11-4-5-12-26/h2-3,6-10,13-14H,4-5,11-12,15H2,1H3,(H,24,25,28)/b20-14+ > WIJXSMYYIJKKSP-XSFVSMFZSA-N > 4.2 > 421.14601278 > C23H23N3O3S > 421.5 > CC1=CC(=CC=C1)NC2=NC(=O)C(=CC3=CC=CC=C3OCC(=O)N4CCCC4)S2 > CC1=CC(=CC=C1)NC2=NC(=O)/C(=C\C3=CC=CC=C3OCC(=O)N4CCCC4)/S2 > 96.3 > 421.14601278 > 0 > 30 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 14 15 8 14 16 8 15 18 8 16 19 8 18 21 8 19 21 8 22 25 8 22 27 8 24 25 8 24 28 8 27 29 8 28 29 8 $$$$