Inchi | 1S/C22H28N6O2/c1-22(2,30)13-26-19(29)11-18-27-17-12-25-21-16(8-10-24-21)20(17)28(18)15-5-3-14(4-6-15)7-9-23/h8,10,12,14-15,30H,3-7,11,13H2,1-2H3,(H,24,25)(H,26,29)/t14-,15- |
InChIKey | NJKMSBSVJSQUBU-SHTZXODSSA-N |
SMILES | C12C(N([C@@H]3CC[C@@H](CC#N)CC3)C(CC(NCC(O)(C)C)=O)=N1)=C1C(=NC=2)NC=C1 |