69758135 -OEChem-03282406212D 61 62 0 1 0 0 0 0 0999 V2000 9.7942 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0000 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 2.8660 -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 1 0 0 0 0 0 0 0 0 0 3.7320 1.0000 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 3.7320 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5000 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 3.7320 4.0000 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 7.1962 2.0000 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 8.0622 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.6200 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 1.4631 -4.3100 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 3.4220 -4.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -3.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1200 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 4.0420 3.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 4.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 15 2 0 0 0 0 3 22 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 5 39 1 0 0 0 0 14 6 1 1 0 0 0 6 22 1 0 0 0 0 6 50 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 7 57 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 49 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 58 1 0 0 0 0 25 27 2 0 0 0 0 25 59 1 0 0 0 0 26 28 2 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 M END > 69758135 > 1 > 499 > 3 > 3 > 7 > AAADcfB7sAAEAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAAABAAAAHgIQAAAADSrBkCQzwIPAAACIACVSUACCAAAhBwAIiIGIZoiIYDLB07GUIAholgLIyCcYAAAMAABAAAAAAAAAAIAAAAAAAAAAAAAAAA== > (2R)-2-[(4-chlorophenyl)carbamoylamino]-N-(1-isopropyl-4-piperidyl)-4-methyl-pentanamide > (2R)-2-[[(4-chloroanilino)-oxomethyl]amino]-4-methyl-N-(1-propan-2-yl-4-piperidinyl)pentanamide > (2R)-2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(1-propan-2-ylpiperidin-4-yl)pentanamide > (2R)-2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(1-propan-2-ylpiperidin-4-yl)pentanamide > (2R)-2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(1-propan-2-ylpiperidin-4-yl)pentanamide > (2R)-2-[(4-chlorophenyl)carbamoylamino]-N-(1-isopropyl-4-piperidyl)-4-methyl-valeramide > InChI=1S/C21H33ClN4O2/c1-14(2)13-19(25-21(28)24-17-7-5-16(22)6-8-17)20(27)23-18-9-11-26(12-10-18)15(3)4/h5-8,14-15,18-19H,9-13H2,1-4H3,(H,23,27)(H2,24,25,28)/t19-/m1/s1 > GNUMYERCNDWBSR-LJQANCHMSA-N > 4 > 408.2292040 > C21H33ClN4O2 > 409.0 > CC(C)CC(C(=O)NC1CCN(CC1)C(C)C)NC(=O)NC2=CC=C(C=C2)Cl > CC(C)C[C@H](C(=O)NC1CCN(CC1)C(C)C)NC(=O)NC2=CC=C(C=C2)Cl > 73.5 > 408.2292040 > 0 > 28 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 23 24 8 23 25 8 24 26 8 25 27 8 26 28 8 27 28 8 14 6 5 $$$$