triazolopyridinone epoxide

Properties Image MNX_ID MNXM161865 reference hmdb:HMDB0061059 formula C19H22ClN5O2 global charge 0 mol weight 387.871 InChIKey QFERKVDPWYTEPE-UHFFFAOYSA-N InChI InChI=1S/C19H22ClN5O2/c20-14-3-1-4-15(13-14)23-11-9-22(10-12-23)6-2-7-25-19(26)24-8-5-16-17(27-16)18(24)21-25/h1,3-5,8,13,16-17H,2,6-7,9-12H2 SMILES O=C1N(CCCN2CCN(C3=CC=CC(Cl)=C3)CC2)N=C2C3OC3C=CN12 MNX internals InChI (mnx) InChI=1/C19H22ClN5O2/c20-14-3-1-4-15(13-14)23-11-9-22(10-12-23)6-2-7-25-19(26)24-8-5-16-17(27-16)18(24)21-25/h1,3-5,8,13,16-17H,2,6-7,9-12H2/t16?,17? SMILES (mnx) [CH:1]1=[CH:3][C:14]([Cl:20])=[CH:13][C:15]([N:23]2[CH2:11][CH2:9][N:22]([CH2:6][CH2:2][CH2:7][N:25]3[C:19](=[O:26])[N:24]4[CH:8]=[CH:5][CH:16]5[CH:17]([C:18]4=[N:21]3)[O:27]5)[CH2:10][CH2:12]2)=[CH:4]1

Parent-child relations graph

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