Sulfamonomethoxine hydrate (JP18)

Properties Image MNX_ID MNXM161333 reference keggD:D05023 formula C11H14N4O4S global charge 0 mol weight 298.324 InChIKey IZFXNOZWICAYKQ-UHFFFAOYSA-N InChI InChI=1S/C11H12N4O3S.H2O/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9;/h2-7H,12H2,1H3,(H,13,14,15);1H2 SMILES COC1=NC=NC(NS(=O)(=O)C2=CC=C(N)C=C2)=C1.O MNX internals InChI (mnx) InChI=1/C11H12N4O3S.H2O/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9;/h2-7H,12H2,1H3,(H,13,14,15);1H2 SMILES (mnx) [CH3:1][O:18][C:11]1=[N:14][CH:7]=[N:13][C:10]([NH:15][S:19]([C:9]2=[CH:5][CH:3]=[C:8]([NH2:12])[CH:2]=[CH:4]2)(=[O:16])=[O:17])=[CH:6]1.[OH2:20]

Parent-child relations graph

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