44364500 -OEChem-04192416522D 69 72 0 1 0 0 0 0 0999 V2000 7.1962 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 13.2583 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6603 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7214 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4534 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7214 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 24 1 0 0 0 0 2 14 1 0 0 0 0 2 55 1 0 0 0 0 3 14 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 42 1 0 0 0 0 5 22 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 21 2 0 0 0 0 7 28 1 0 0 0 0 7 37 2 0 0 0 0 8 68 1 0 0 0 0 8 69 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 21 1 0 0 0 0 13 23 2 0 0 0 0 15 19 1 0 0 0 0 15 43 1 0 0 0 0 16 20 2 0 0 0 0 16 44 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 25 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 27 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 26 1 0 0 0 0 23 52 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 28 32 2 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 33 1 0 0 0 0 30 59 1 0 0 0 0 31 34 2 0 0 0 0 31 60 1 0 0 0 0 32 36 1 0 0 0 0 32 61 1 0 0 0 0 33 35 2 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 36 38 2 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 M END > 44364500 > 1 > 735 > 8 > 3 > 12 > AAADceB7sAAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAAAB1AAAHgAYCAAADCzhmgY//pPKFgCoAzb3bACCiCkxIiAJ2KG+bJiOJvLEubuHeCjs0BPY6CeYyOCOIAAAAAACAABAAAAAAAQAAAAAAAAAAA== > 3-[4-[2-[methyl(2-pyridyl)amino]ethoxy]phenyl]-2-[2-[(E)-phenylcarbonohydrazonoyl]anilino]propanoic acid > 2-[2-[(E)-hydrazinylidene(phenyl)methyl]anilino]-3-[4-[2-[methyl(2-pyridinyl)amino]ethoxy]phenyl]propanoic acid > 3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[2-[(E)-C-phenylcarbonohydrazonoyl]anilino]propanoic acid > 3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[2-[(E)-C-phenylcarbonohydrazonoyl]anilino]propanoic acid > 3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[[2-[(E)-C-phenylcarbonohydrazonoyl]phenyl]amino]propanoic acid > 3-[4-[2-[methyl(2-pyridyl)amino]ethoxy]phenyl]-2-[2-[(E)-phenylcarbohydrazonoyl]anilino]propionic acid > InChI=1S/C30H31N5O3/c1-35(28-13-7-8-18-32-28)19-20-38-24-16-14-22(15-17-24)21-27(30(36)37)33-26-12-6-5-11-25(26)29(34-31)23-9-3-2-4-10-23/h2-18,27,33H,19-21,31H2,1H3,(H,36,37)/b34-29+ > MZOMKUYJYYAAQK-RIHQVDFKSA-N > 5.8 > 509.24268987 > C30H31N5O3 > 509.6 > CN(CCOC1=CC=C(C=C1)CC(C(=O)O)NC2=CC=CC=C2C(=NN)C3=CC=CC=C3)C4=CC=CC=N4 > CN(CCOC1=CC=C(C=C1)CC(C(=O)O)NC2=CC=CC=C2/C(=N/N)/C3=CC=CC=C3)C4=CC=CC=N4 > 113 > 509.24268987 > 0 > 38 > 0 > 1 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 11 15 8 11 16 8 12 13 8 12 18 8 13 23 8 15 19 8 16 20 8 17 19 8 17 20 8 18 25 8 23 26 8 25 26 8 27 30 8 27 31 8 28 32 8 30 33 8 31 34 8 32 36 8 33 35 8 34 35 8 36 38 8 37 38 8 7 28 8 7 37 8 9 10 3 $$$$