70695054 -OEChem-05122404482D 56 59 0 1 0 0 0 0 0999 V2000 7.1962 -0.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -1.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 22 2 0 0 0 0 7 3 1 6 0 0 0 3 11 1 0 0 0 0 3 36 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 4 39 1 0 0 0 0 5 22 1 0 0 0 0 5 24 1 0 0 0 0 5 49 1 0 0 0 0 6 31 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 20 1 0 0 0 0 14 40 1 0 0 0 0 15 21 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 24 2 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 18 43 1 0 0 0 0 19 27 2 0 0 0 0 19 44 1 0 0 0 0 20 23 2 0 0 0 0 20 45 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 28 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 31 1 0 0 0 0 29 53 1 0 0 0 0 30 32 2 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 M END > 70695054 > 1 > 699 > 4 > 3 > 8 > AAADceB7sAAAAAAAAAAAAAAAAAAAAAAAAAA8YIEAAAAAAAAB0AAAHgAQAAAADCjBmgQ8gJLIEACoAjV3VACCgCAxAiAI2KG4ZNgIYHLAkbGUIAhglgDIyYcYiICOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2S)-2-(benzylamino)-N-[2-oxo-5-(4-pyridyl)-1H-pyridin-3-yl]-3-phenyl-propanamide > (2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-[(phenylmethyl)amino]propanamide > (2S)-2-(benzylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide > (2S)-2-(benzylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide > (2S)-N-(2-oxidanylidene-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-[(phenylmethyl)amino]propanamide > (2S)-2-(benzylamino)-N-[2-keto-5-(4-pyridyl)-1H-pyridin-3-yl]-3-phenyl-propionamide > InChI=1S/C26H24N4O2/c31-25-24(16-22(18-29-25)21-11-13-27-14-12-21)30-26(32)23(15-19-7-3-1-4-8-19)28-17-20-9-5-2-6-10-20/h1-14,16,18,23,28H,15,17H2,(H,29,31)(H,30,32)/t23-/m0/s1 > WVKVQKABUSFKGP-QHCPKHFHSA-N > 2.8 > 424.18992602 > C26H24N4O2 > 424.5 > C1=CC=C(C=C1)CC(C(=O)NC2=CC(=CNC2=O)C3=CC=NC=C3)NCC4=CC=CC=C4 > C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC(=CNC2=O)C3=CC=NC=C3)NCC4=CC=CC=C4 > 83.1 > 424.18992602 > 0 > 32 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 14 8 10 15 8 12 18 8 12 19 8 13 16 8 13 22 8 14 20 8 15 21 8 16 17 8 17 24 8 18 26 8 19 27 8 20 23 8 21 23 8 25 29 8 25 30 8 26 28 8 27 28 8 29 31 8 7 3 6 30 32 8 5 22 8 5 24 8 6 31 8 6 32 8 $$$$