24789646 -OEChem-04252412142D 68 72 0 0 0 0 0 0 0999 V2000 4.6660 -6.7500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 3.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 4.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 -3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4762 -3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8747 -3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 -2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8747 -2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4762 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 -4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 4.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 4.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8201 1.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4401 2.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6162 6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3762 6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 17 2 0 0 0 0 3 24 2 0 0 0 0 4 28 2 0 0 0 0 5 33 1 0 0 0 0 5 39 1 0 0 0 0 6 38 1 0 0 0 0 6 40 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 9 18 1 0 0 0 0 9 24 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 25 2 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 21 1 0 0 0 0 19 51 1 0 0 0 0 20 22 2 0 0 0 0 20 52 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 1 0 0 0 0 27 31 2 0 0 0 0 29 33 2 0 0 0 0 29 35 1 0 0 0 0 30 32 1 0 0 0 0 30 56 1 0 0 0 0 31 34 1 0 0 0 0 31 57 1 0 0 0 0 32 34 2 0 0 0 0 32 58 1 0 0 0 0 33 36 1 0 0 0 0 34 59 1 0 0 0 0 35 37 2 0 0 0 0 35 60 1 0 0 0 0 36 38 2 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 39 63 1 0 0 0 0 39 64 1 0 0 0 0 39 65 1 0 0 0 0 40 66 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 M END > 24789646 > 1 > 957 > 7 > 1 > 7 > AAADceB7uAAEAAAAAAAAAAAAAAAAAAAAAAA8YMECAAAAAACBUAAAHgIYAAAADA7BmCYyxoPABACoAyVyUACSDAAlJwAaiIGvbtgOZ7LFt7uVMShlzhXY6Ye464yOgEAACAIQEAAAgAAQBCAgAAAAAAAAAA== > N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-3-(2,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxamide > N-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-3-(2,4-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxamide > N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-3-(2,4-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide > N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-3-(2,4-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide > N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide > N-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-3-(2,4-dimethoxyphenyl)-4-keto-phthalazine-1-carboxamide > InChI=1S/C29H28ClN5O5/c1-39-21-10-11-24(25(17-21)40-2)35-29(38)23-9-4-3-8-22(23)27(32-35)28(37)31-18-26(36)34-14-12-33(13-15-34)20-7-5-6-19(30)16-20/h3-11,16-17H,12-15,18H2,1-2H3,(H,31,37) > SWMROFPDELSDBZ-UHFFFAOYSA-N > 3.8 > 561.1778967 > C29H28ClN5O5 > 562.0 > COC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl)OC > COC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl)OC > 104 > 561.1778967 > 0 > 40 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 8 10 28 8 11 25 8 16 19 8 16 20 8 19 21 8 20 22 8 21 23 8 22 23 8 25 26 8 26 27 8 26 30 8 27 28 8 27 31 8 29 33 8 29 35 8 30 32 8 31 34 8 32 34 8 33 36 8 35 37 8 36 38 8 37 38 8 $$$$