null CDK 0224162153 null 26 29 0 0 0 0 0 0 0 0999 V2000 5.3123 2.6162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2476 1.7938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5441 1.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7367 0.5605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5591 0.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8749 1.2579 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2295 -0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -0.8294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4046 -0.0994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 0.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0974 0.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4864 0.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 1.6485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4466 1.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0576 1.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7969 1.7124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7876 2.5373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4974 2.9578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0686 2.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0594 3.7667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3403 4.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3311 4.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0409 5.4166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 5.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7692 4.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0317 6.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 15 16 1 0 0 0 0 16 3 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 23 26 1 0 0 0 0 M END > CHEBI:92110 > 1-methyl-10-[2-(4-methyl-1-piperazinyl)-1-oxoethyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one > 2 > C19H22N4O2S > 370.470 > 370.14635 > 0 > CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)CN4CCN(CC4)C > InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25) > VSWPGAIWKHPTKX-UHFFFAOYSA-N > LSM-2111 $$$$