7-benzyl-1,3-dimethyl-8-piperazin-1-yl-3,7-dihydropurine-2,6-dione

Properties Image MNX_ID MNXM39072 reference chebi:45565 formula C18H22N6O2 global charge 0 mol weight 354.414 InChIKey QFSMMXJBEBXTJP-UHFFFAOYSA-N InChI InChI=1S/C18H22N6O2/c1-21-15-14(16(25)22(2)18(21)26)24(12-13-6-4-3-5-7-13)17(20-15)23-10-8-19-9-11-23/h3-7,19H,8-12H2,1-2H3 SMILES CN1C(=O)C2=C(N=C(N3CCNCC3)N2CC2=CC=CC=C2)N(C)C1=O MNX internals InChI (mnx) InChI=1/C18H22N6O2/c1-21-15-14(16(25)22(2)18(21)26)24(12-13-6-4-3-5-7-13)17(20-15)23-10-8-19-9-11-23/h3-7,19H,8-12H2,1-2H3 SMILES (mnx) [CH3:1][N:21]1[C:15]2=[C:14]([C:16](=[O:25])[N:22]([CH3:2])[C:18]1=[O:26])[N:24]([CH2:12][C:13]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[C:17]([N:23]1[CH2:10][CH2:8][NH:19][CH2:9][CH2:11]1)=[N:20]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0