1-[1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-3-(3-nitrophenyl)thiourea

Properties Image MNX_ID MNXM340727 reference chebi:93914 formula C15H19N5O2S global charge 0 mol weight 333.417 InChIKey XZDUKSHHCKAMIC-UHFFFAOYSA-N InChI InChI=1S/C15H19N5O2S/c1-4-19-9-14(11(3)18-19)10(2)16-15(23)17-12-6-5-7-13(8-12)20(21)22/h5-10H,4H2,1-3H3,(H2,16,17,23) SMILES CCN1C=C(C(C)NC(=S)NC2=CC([N+](=O)[O-])=CC=C2)C(C)=N1 MNX internals InChI (mnx) InChI=1/C15H19N5O2S/c1-4-19-9-14(11(3)18-19)10(2)16-15(23)17-12-6-5-7-13(8-12)20(21)22/h5-10H,4H2,1-3H3,(H2,16,17,23)/t10? SMILES (mnx) [CH3:1][CH2:4][N:19]1[CH:9]=[C:14]([CH:10]([CH3:2])[N:16]=[C:15]([NH:17][C:12]2=[CH:8][C:13]([N+:20]([O-:21])=[O:22])=[CH:7][CH:5]=[CH:6]2)[SH:23])[C:11]([CH3:3])=[N:18]1

Parent-child relations graph

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