Benzylhydrochlorothiazide

Properties Image MNX_ID MNXM43671 reference chebi:31269 formula C14H14ClN3O4S2 global charge 0 mol weight 387.87 InChIKey BWSSMIJUDVUASQ-UHFFFAOYSA-N InChI InChI=1S/C14H14ClN3O4S2/c15-10-7-11-13(8-12(10)23(16,19)20)24(21,22)18-14(17-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,17-18H,6H2,(H2,16,19,20) SMILES NS(=O)(=O)C1=CC2=C(C=C1Cl)NC(CC1=CC=CC=C1)NS2(=O)=O MNX internals InChI (mnx) InChI=1/C14H14ClN3O4S2/c15-10-7-11-13(8-12(10)23(16,19)20)24(21,22)18-14(17-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,17-18H,6H2,(H2,16,19,20)/t14? SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:9]([CH2:6][CH:14]2[NH:17][C:11]3=[C:13]([CH:8]=[C:12]([S:23]([NH2:16])(=[O:19])=[O:20])[C:10]([Cl:15])=[CH:7]3)[S:24](=[O:21])(=[O:22])[NH:18]2)[CH:5]=[CH:3]1

Parent-child relations graph

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