70155273 -OEChem-03282404262D 58 61 0 0 0 0 0 0 0999 V2000 2.8660 2.2821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.2821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5567 -3.7321 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2887 -3.7522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3465 1.2475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3233 -0.7524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 -2.2623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.7613 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 4.3168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4285 -3.2422 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7410 -4.7922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4747 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2067 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4632 -0.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1951 -0.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 2.2474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3118 -1.7523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 -2.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1604 -3.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0206 -3.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0090 -4.7721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8924 -3.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8692 -5.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7525 -3.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2694 1.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 0.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8160 0.6228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4254 1.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8539 -0.1277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2444 -0.8225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4004 -0.8474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 -0.1618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -1.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9067 -1.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5511 -3.1475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9416 -3.8423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 4.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4686 -5.0759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8995 -2.6623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8620 -5.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2930 -3.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.0921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.2452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 5.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 5.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 32 1 0 0 0 0 2 26 1 0 0 0 0 2 33 1 0 0 0 0 3 10 1 0 0 0 0 4 10 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 7 42 1 0 0 0 0 8 16 2 0 0 0 0 8 25 1 0 0 0 0 9 19 1 0 0 0 0 9 25 2 0 0 0 0 10 20 1 0 0 0 0 11 30 2 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 3 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 23 2 0 0 0 0 20 43 1 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 26 1 0 0 0 0 23 47 1 0 0 0 0 24 26 2 0 0 0 0 25 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M CHG 2 3 -1 10 1 M END > 70155273 > 1 > 662 > 10 > 1 > 7 > AAADceB7uAAAAAAAAAAAAAAAAAAAAAAAAAA8WLEAAAAAAACx/AAAHgAUAAAADAzBngY/9vfYVAChAzZnZwCCiCkxIqAJ2KA+7JiNbuLE+duUNCpuwBvK6Cew0BMOIEABAgACQABAgAIEAASAAAAAAAAAAA== > 1-[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]-2-nitro-N-(4-pyridylmethyl)ethenamine > 1-[4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinyl]-2-nitro-N-(pyridin-4-ylmethyl)ethenamine > 1-[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]-2-nitro-N-(pyridin-4-ylmethyl)ethenamine > 1-[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]-2-nitro-N-(pyridin-4-ylmethyl)ethenamine > 1-[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]-2-nitro-N-(pyridin-4-ylmethyl)ethenamine > [1-[4-(6,7-dimethoxyquinazolin-4-yl)piperazino]-2-nitro-vinyl]-(4-pyridylmethyl)amine > InChI=1S/C22H25N7O4/c1-32-19-11-17-18(12-20(19)33-2)25-15-26-22(17)28-9-7-27(8-10-28)21(14-29(30)31)24-13-16-3-5-23-6-4-16/h3-6,11-12,14-15,24H,7-10,13H2,1-2H3 > UUAXPBNNQZJQJN-UHFFFAOYSA-N > 2.6 > 451.19680230 > C22H25N7O4 > 451.5 > COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=C[N+](=O)[O-])NCC4=CC=NC=C4)OC > COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=C[N+](=O)[O-])NCC4=CC=NC=C4)OC > 122 > 451.19680230 > 0 > 33 > 0 > 0 > 0 > 1 > 0 > 1 > -1 > 1 5 255 > 11 30 8 11 31 8 16 18 8 17 20 1 18 19 8 18 21 8 19 23 8 21 24 8 23 26 8 24 26 8 27 28 8 27 29 8 28 30 8 29 31 8 8 16 8 8 25 8 9 19 8 9 25 8 $$$$