68505000 -OEChem-05082409432D 70 74 0 1 0 0 0 0 0999 V2000 9.8622 -4.8318 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -4.8318 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 3.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 0.1923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.8560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6988 4.1627 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.7282 1.6682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.1682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.1682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.3318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.8318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 3.1682 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5078 2.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1769 3.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6769 4.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9556 4.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 0.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -1.8665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -4.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -4.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -4.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 0.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0742 3.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1978 2.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 2.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0742 -0.4144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4728 0.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 2.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 2.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5918 3.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6785 3.8690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2433 4.6228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4853 4.9603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 -0.8068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 -0.8068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9181 1.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5195 1.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 1.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3705 5.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4949 5.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5407 4.3711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 0.8228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -2.4864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8611 -3.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -5.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -3.0218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 1.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 1.8123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 1.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 -0.8212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -1.0514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -1.8974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 2 32 1 0 0 0 0 3 21 2 0 0 0 0 4 29 1 0 0 0 0 4 36 1 0 0 0 0 5 30 1 0 0 0 0 5 37 1 0 0 0 0 6 13 1 0 0 0 0 6 18 1 0 0 0 0 6 22 1 0 0 0 0 7 12 1 0 0 0 0 7 21 1 0 0 0 0 7 55 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 23 1 0 0 0 0 9 23 2 0 0 0 0 9 24 1 0 0 0 0 10 23 1 0 0 0 0 10 25 2 0 0 0 0 11 25 1 0 0 0 0 11 31 1 0 0 0 0 11 61 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 1 0 0 0 13 40 1 0 0 0 0 14 17 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 19 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 20 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 24 26 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 26 28 2 0 0 0 0 27 29 1 0 0 0 0 27 59 1 0 0 0 0 28 30 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 33 35 2 0 0 0 0 33 62 1 0 0 0 0 34 38 2 0 0 0 0 34 63 1 0 0 0 0 35 38 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 M END > 68505000 > 1 > 792 > 9 > 2 > 7 > AAADcfB7sQAEAAAAAAAAAAAAAAAAAWAAAAA8eIEAAAAAAACx9AAAHwIQAAAADC7Bni4z9vfIFACoAydydACCiCkhJ6AJmKG+7piNbvLF+/uUNCpu1hvK6Ce40RMOIEBBAgACQABAgIIEAASAAAAAAAAAAA== > (2S)-N-[1-[4-(4-chloro-2-fluoro-anilino)-6,7-dimethoxy-quinazolin-2-yl]-4-piperidyl]-1-methyl-pyrrolidine-2-carboxamide > (2S)-N-[1-[4-(4-chloro-2-fluoroanilino)-6,7-dimethoxy-2-quinazolinyl]-4-piperidinyl]-1-methyl-2-pyrrolidinecarboxamide > (2S)-N-[1-[4-(4-chloro-2-fluoroanilino)-6,7-dimethoxyquinazolin-2-yl]piperidin-4-yl]-1-methylpyrrolidine-2-carboxamide > (2S)-N-[1-[4-(4-chloro-2-fluoroanilino)-6,7-dimethoxyquinazolin-2-yl]piperidin-4-yl]-1-methylpyrrolidine-2-carboxamide > (2S)-N-[1-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6,7-dimethoxy-quinazolin-2-yl]piperidin-4-yl]-1-methyl-pyrrolidine-2-carboxamide > (2S)-N-[1-[4-(4-chloro-2-fluoro-anilino)-6,7-dimethoxy-quinazolin-2-yl]-4-piperidyl]-1-methyl-pyrrolidine-2-carboxamide > InChI=1S/C27H32ClFN6O3/c1-34-10-4-5-22(34)26(36)30-17-8-11-35(12-9-17)27-32-21-15-24(38-3)23(37-2)14-18(21)25(33-27)31-20-7-6-16(28)13-19(20)29/h6-7,13-15,17,22H,4-5,8-12H2,1-3H3,(H,30,36)(H,31,32,33)/t22-/m0/s1 > IMBXONMEVQEJQA-QFIPXVFZSA-N > 5 > 542.2208448 > C27H32ClFN6O3 > 543.0 > CN1CCCC1C(=O)NC2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)NC5=C(C=C(C=C5)Cl)F)OC)OC > CN1CCC[C@H]1C(=O)NC2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)NC5=C(C=C(C=C5)Cl)F)OC)OC > 91.8 > 542.2208448 > 0 > 38 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 23 8 10 25 8 13 21 5 24 26 8 24 27 8 25 26 8 26 28 8 27 29 8 28 30 8 29 30 8 31 32 8 31 33 8 32 34 8 33 35 8 34 38 8 35 38 8 9 23 8 9 24 8 $$$$