71571536 -OEChem-05112409062D 73 77 0 1 0 0 0 0 0999 V2000 6.9473 -3.8680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.5633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1684 1.7498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.0633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5256 0.0550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4146 3.3190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -2.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.5633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5633 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -2.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -3.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 -1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.5633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -3.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 -1.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1254 2.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5901 -0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8148 1.2117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1039 2.3684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 0.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9007 0.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8363 1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -2.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -3.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -2.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -3.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3931 3.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7467 4.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5309 -3.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -0.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -0.7533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -1.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -1.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6505 -1.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1049 2.7819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5116 2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 -0.6916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8353 0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4286 1.1243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1245 1.7488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7177 2.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 0.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0718 1.1824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9397 -0.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4867 0.8483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7209 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7209 -4.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3409 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3409 -4.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5210 2.9185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9998 3.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2652 4.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2082 4.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3327 4.5247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2853 3.6492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1509 -3.0633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 2 17 1 0 0 0 0 2 65 1 0 0 0 0 3 29 2 0 0 0 0 11 4 1 6 0 0 0 4 12 1 0 0 0 0 4 42 1 0 0 0 0 5 12 1 0 0 0 0 5 30 2 0 0 0 0 6 15 2 0 0 0 0 6 30 1 0 0 0 0 7 21 1 0 0 0 0 7 29 1 0 0 0 0 7 56 1 0 0 0 0 8 24 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 41 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 22 1 0 0 0 0 16 25 2 0 0 0 0 16 26 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 31 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 45 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 27 2 0 0 0 0 22 28 2 0 0 0 0 22 48 1 0 0 0 0 23 29 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 33 1 0 0 0 0 25 53 1 0 0 0 0 26 34 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 57 1 0 0 0 0 30 58 1 0 0 0 0 31 35 1 0 0 0 0 31 59 1 0 0 0 0 32 36 2 0 0 0 0 32 60 1 0 0 0 0 33 37 2 0 0 0 0 33 61 1 0 0 0 0 34 37 1 0 0 0 0 34 62 1 0 0 0 0 35 40 2 0 0 0 0 35 63 1 0 0 0 0 36 40 1 0 0 0 0 36 64 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 40 73 1 0 0 0 0 M END > 71571536 > 1 > 772 > 7 > 3 > 11 > AAADcfB/sAAAAAAAAAAAAAAAAAAAASAAAAA8YMEAAAAAAFgB/AAAHgAQCAAADCzhmgY39NfIFkCoAqdzdACCiCk9IqAJ2KEsbNiOPjrE/duOfaju1xvY6ee82fOegAAAQAAAAAAAAACAAAAAAAAAAAAAAA== > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]-6-phenyl-furo[2,3-d]pyrimidin-5-yl]phenyl]butanamide > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenyl-5-furo[2,3-d]pyrimidinyl]phenyl]butanamide > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]butanamide > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]butanamide > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]-6-phenyl-furo[2,3-d]pyrimidin-5-yl]phenyl]butanamide > 4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]-6-phenyl-furo[2,3-d]pyrimidin-5-yl]phenyl]butyramide > InChI=1S/C32H33N5O3/c1-37(2)18-10-17-27(39)35-25-16-9-15-24(19-25)28-29-31(36-26(20-38)22-11-5-3-6-12-22)33-21-34-32(29)40-30(28)23-13-7-4-8-14-23/h3-9,11-16,19,21,26,38H,10,17-18,20H2,1-2H3,(H,35,39)(H,33,34,36)/t26-/m1/s1 > KPTUKIAZZFDEOC-AREMUKBSSA-N > 4.9 > 535.25833993 > C32H33N5O3 > 535.6 > CN(C)CCCC(=O)NC1=CC=CC(=C1)C2=C(OC3=NC=NC(=C23)NC(CO)C4=CC=CC=C4)C5=CC=CC=C5 > CN(C)CCCC(=O)NC1=CC=CC(=C1)C2=C(OC3=NC=NC(=C23)N[C@H](CO)C4=CC=CC=C4)C5=CC=CC=C5 > 104 > 535.25833993 > 0 > 40 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 13 8 1 15 8 10 12 8 10 15 8 14 19 8 14 22 8 16 25 8 16 26 8 18 31 8 18 32 8 19 21 8 21 27 8 22 28 8 25 33 8 26 34 8 27 28 8 31 35 8 32 36 8 33 37 8 34 37 8 35 40 8 36 40 8 11 4 6 5 12 8 5 30 8 6 15 8 6 30 8 9 10 8 9 13 8 $$$$