compound 0285024

Properties Image MNX_ID MNXM1170789 reference envipathM:...6cc3d8fc4720 formula C18H17F2N3O2 global charge 0 mol weight 345.349 InChIKey TYVQUJKULUOHNU-LZRTYROISA-N InChI InChI=1S/C18H17F2N3O2/c1-8-10-6-13(24)14(8)15-9(10)4-3-5-12(15)21-18(25)11-7-23(2)22-16(11)17(19)20/h3-5,7,10,13-14,17,24H,1,6H2,2H3,(H,21,25)/t10-,13?,14-/m0/s1 SMILES C=C1[C@@H]2CC(O)[C@H]1C1=C(NC(=O)C3=CN(C)N=C3C(F)F)C=CC=C12 MNX internals InChI (mnx) InChI=1/C18H17F2N3O2/c1-8-10-6-13(24)14(8)15-9(10)4-3-5-12(15)21-18(25)11-7-23(2)22-16(11)17(19)20/h3-5,7,10,13-14,17,24H,1,6H2,2H3,(H,21,25)/t10-,13?,14-/m0/s1 SMILES (mnx) [CH2:1]=[C:8]1[C@@H:10]2[CH2:6][CH:13]([OH:24])[C@H:14]1[C:15]1=[C:9]2[CH:4]=[CH:3][CH:5]=[C:12]1[N:21]=[C:18]([C:11]1=[CH:7][N:23]([CH3:2])[N:22]=[C:16]1[CH:17]([F:19])[F:20])[OH:25]

Parent-child relations graph

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