Denotivir (INN)

Properties Image MNX_ID MNXM49052 reference keggD:D07789 formula C18H14ClN3O2S global charge 0 mol weight 371.849 InChIKey ZPBLNADJHWHOEP-UHFFFAOYSA-N InChI InChI=1S/C18H14ClN3O2S/c1-11-15(17(24)20-14-9-7-13(19)8-10-14)18(25-22-11)21-16(23)12-5-3-2-4-6-12/h2-10H,1H3,(H,20,24)(H,21,23) SMILES CC1=NSC(NC(=O)C2=CC=CC=C2)=C1C(=O)NC1=CC=C(Cl)C=C1 MNX internals InChI (mnx) InChI=1/C18H14ClN3O2S/c1-11-15(17(24)20-14-9-7-13(19)8-10-14)18(25-22-11)21-16(23)12-5-3-2-4-6-12/h2-10H,1H3,(H,20,24)(H,21,23) SMILES (mnx) [CH3:1][C:11]1=[N:22][S:25][C:18]([N:21]=[C:16]([C:12]2=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]2)[OH:23])=[C:15]1[C:17]([NH:20][C:14]1=[CH:10][CH:8]=[C:13]([Cl:19])[CH:7]=[CH:9]1)=[O:24]

Parent-child relations graph

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