68738304 -OEChem-05072417092D 63 66 0 0 0 0 0 0 0999 V2000 6.3301 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.7500 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 8.9282 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.2500 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 9.7942 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.7500 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 3.7320 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.7500 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 16.7224 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3195 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1254 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1254 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 21 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 12 2 0 0 0 0 5 18 1 0 0 0 0 6 21 1 0 0 0 0 6 25 1 0 0 0 0 6 53 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 16 2 0 0 0 0 14 44 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 46 1 0 0 0 0 19 22 1 0 0 0 0 19 47 1 0 0 0 0 20 23 2 0 0 0 0 20 48 1 0 0 0 0 22 24 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 31 1 0 0 0 0 29 59 1 0 0 0 0 30 32 2 0 0 0 0 30 60 1 0 0 0 0 31 33 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 M END > 68738304 > 1 > 620 > 4 > 1 > 7 > AAADceB7sAAAAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAAAB0AAAHgAQAAAADADBmgQ/sJPIEACoAjN3dACCgCk1AiAJ2KE4ZNiIYPrA3ZGUIYholgLIyecYicCOQAAAAAAAAACAAAAAAAAAAAAAAAAAAA== > N-(2-phenylethyl)-6-[4-[2-(p-tolyl)acetyl]piperazin-1-yl]pyridine-3-carboxamide > 6-[4-[2-(4-methylphenyl)-1-oxoethyl]-1-piperazinyl]-N-(2-phenylethyl)-3-pyridinecarboxamide > 6-[4-[2-(4-methylphenyl)acetyl]piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide > 6-[4-[2-(4-methylphenyl)acetyl]piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide > 6-[4-[2-(4-methylphenyl)ethanoyl]piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide > N-phenethyl-6-[4-[2-(p-tolyl)acetyl]piperazino]nicotinamide > InChI=1S/C27H30N4O2/c1-21-7-9-23(10-8-21)19-26(32)31-17-15-30(16-18-31)25-12-11-24(20-29-25)27(33)28-14-13-22-5-3-2-4-6-22/h2-12,20H,13-19H2,1H3,(H,28,33) > TZRLQCVXRIYRCS-UHFFFAOYSA-N > 3.8 > 442.23687621 > C27H30N4O2 > 442.6 > CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(=O)NCCC4=CC=CC=C4 > CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(=O)NCCC4=CC=CC=C4 > 65.5 > 442.23687621 > 0 > 33 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 14 8 14 16 8 15 19 8 15 20 8 16 17 8 17 18 8 19 22 8 20 23 8 22 24 8 23 24 8 27 29 8 27 30 8 29 31 8 30 32 8 31 33 8 32 33 8 5 12 8 5 18 8 $$$$