69893746 -OEChem-04252400162D 65 69 0 1 0 0 0 0 0999 V2000 5.4400 -2.2422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8924 -3.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8692 -5.2821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 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 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 7.2067 0.7375 0.0000 C 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 7.1951 -0.2624 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 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 7.1604 -3.2622 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2887 -3.7522 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 5.4285 -3.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5567 -3.7321 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 6.2771 -4.7521 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 4.5981 2.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5452 -4.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4054 -5.2420 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 8.0090 -4.7721 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 9.7525 -3.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -4.7922 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 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 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 7.4004 -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 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 6.6271 -2.9460 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 5.8325 -2.7719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0355 -2.7626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3514 -3.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9449 -3.8327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8104 -5.0683 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 4.0047 -5.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3982 -5.8620 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 10.2930 -3.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2743 -5.1083 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 16 2 0 0 0 0 2 22 1 0 0 0 0 2 33 1 0 0 0 0 3 31 1 0 0 0 0 3 34 1 0 0 0 0 4 29 1 0 0 0 0 4 35 1 0 0 0 0 5 32 1 0 0 0 0 5 36 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 16 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 46 1 0 0 0 0 9 15 2 0 0 0 0 9 30 1 0 0 0 0 10 24 1 0 0 0 0 10 30 2 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 45 1 0 0 0 0 18 20 1 0 0 0 0 18 23 2 0 0 0 0 19 24 1 0 0 0 0 19 25 2 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 26 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 31 2 0 0 0 0 23 27 1 0 0 0 0 23 51 1 0 0 0 0 24 28 2 0 0 0 0 25 29 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 32 1 0 0 0 0 28 55 1 0 0 0 0 29 32 2 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 M END > 69893746 > 1 > 897 > 8 > 1 > 6 > AAADceB7uAAAAAAAAAAAAAAAAAAAAAAAAAA8WIECAAAAAACx8AAAHgAQAAAADCzhngY39vfIFACoAyZjdACCiCkxIqAJ2KA+7JiPbqLE+duVNCpuxhva6Cew0BMOIEABAgACQABAgAIEAASAAAAAAAAAAA== > N-[cyclohexa-1,3-dien-1-yl(1,4-dioxin-2-yl)methyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide > N-[1-cyclohexa-1,3-dienyl(1,4-dioxin-2-yl)methyl]-4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarboxamide > N-[cyclohexa-1,3-dien-1-yl(1,4-dioxin-2-yl)methyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide > N-[cyclohexa-1,3-dien-1-yl(1,4-dioxin-2-yl)methyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide > N-[cyclohexa-1,3-dien-1-yl(1,4-dioxin-2-yl)methyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide > N-[cyclohexa-1,3-dien-1-yl(p-dioxin-2-yl)methyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide > InChI=1S/C26H29N5O5/c1-33-21-14-19-20(15-22(21)34-2)27-17-28-25(19)30-8-10-31(11-9-30)26(32)29-24(18-6-4-3-5-7-18)23-16-35-12-13-36-23/h3-4,6,12-17,24H,5,7-11H2,1-2H3,(H,29,32) > WDUJMBPQCWJGCV-UHFFFAOYSA-N > 2.3 > 491.21686904 > C26H29N5O5 > 491.5 > COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC(C4=CC=CCC4)C5=COC=CO5)OC > COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC(C4=CC=CCC4)C5=COC=CO5)OC > 98.3 > 491.21686904 > 0 > 36 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 24 8 10 30 8 15 19 8 19 24 8 19 25 8 24 28 8 25 29 8 28 32 8 29 32 8 17 8 3 9 15 8 9 30 8 $$$$