null CDK 0224162333 null 22 23 0 0 0 0 0 0 0 0999 V2000 2.1434 10.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 9.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 9.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9684 9.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 8.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 8.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 7.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 6.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 7.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 8.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 5.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 5.5286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 5.5286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 4.7036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0964 4.2187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 3.4340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 3.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7615 4.2187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5315 2.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8671 2.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 2.8528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7739 2.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 14 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 M END > CHEBI:109731 > 3-[[(4-tert-butylphenyl)-oxomethyl]amino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester > 2 > C15H18N4O3 > 302.329 > 302.13789 > 0 > CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NNC(=N2)C(=O)OC > InChI=1S/C15H18N4O3/c1-15(2,3)10-7-5-9(6-8-10)12(20)17-14-16-11(18-19-14)13(21)22-4/h5-8H,1-4H3,(H2,16,17,18,19,20) > LVKKWCOINMSBPK-UHFFFAOYSA-N > LSM-21159 $$$$