51753223 -OEChem-03282413522D 61 63 0 1 0 0 0 0 0999 V2000 3.7320 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 3.2445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 1.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 3.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2386 1.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 -0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 2.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 4.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 20 1 0 0 0 0 2 29 1 0 0 0 0 3 17 2 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 4 41 1 0 0 0 0 12 5 1 1 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 42 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 20 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 19 1 0 0 0 0 16 24 1 0 0 0 0 17 21 1 0 0 0 0 18 22 2 0 0 0 0 18 45 1 0 0 0 0 19 23 2 0 0 0 0 19 46 1 0 0 0 0 20 25 2 0 0 0 0 21 26 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 27 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 28 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 M END > 51753223 > 1 > 546 > 3 > 1 > 7 > AAADcfB7MAAAAAAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAAABwAAAHgAQAAAADCzhmAYyBIPABECIAqlSkACCCAAkIAAIiIGODMgOZjKEtTuXOSjk1hGYqYeYmcKOwAACAAAQAACAAAQAACAAAAAAAAAAAA== > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-oxo-ethyl]-N-(2-furylmethyl)propanamide > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-oxoethyl]-N-(2-furanylmethyl)propanamide > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-oxoethyl]-N-(furan-2-ylmethyl)propanamide > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-oxoethyl]-N-(furan-2-ylmethyl)propanamide > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)propanamide > N-[(1S)-2-(cyclohexylamino)-1-(2,4-dimethylphenyl)-2-keto-ethyl]-N-(2-furfuryl)propionamide > InChI=1S/C24H32N2O3/c1-4-22(27)26(16-20-11-8-14-29-20)23(21-13-12-17(2)15-18(21)3)24(28)25-19-9-6-5-7-10-19/h8,11-15,19,23H,4-7,9-10,16H2,1-3H3,(H,25,28)/t23-/m0/s1 > QTUZWRMKMQIDFL-QHCPKHFHSA-N > 4.4 > 396.24129289 > C24H32N2O3 > 396.5 > CCC(=O)N(CC1=CC=CO1)C(C2=C(C=C(C=C2)C)C)C(=O)NC3CCCCC3 > CCC(=O)N(CC1=CC=CO1)[C@@H](C2=C(C=C(C=C2)C)C)C(=O)NC3CCCCC3 > 62.6 > 396.24129289 > 0 > 29 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 14 16 8 14 18 8 16 19 8 18 22 8 19 23 8 2 20 8 2 29 8 20 25 8 22 23 8 25 28 8 28 29 8 12 5 5 $$$$