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Acediasulfone sodium (INN)

PropertiesImage
MNX_IDMNXM39991 Image of MNXM39991
referencekeggD:D07061
formulaC14H13N2NaO4S
global charge0
mol weight328.325
InChIKeyGPNYXGDUKNYCNI-UHFFFAOYSA-M
InChIInChI=1S/C14H14N2O4S.Na/c15-10-1-5-12(6-2-10)21(19,20)13-7-3-11(4-8-13)16-9-14(17)18;/h1-8,16H,9,15H2,(H,17,18);/q;+1/p-1
SMILESNC1=CC=C(S(=O)(=O)C2=CC=C(NCC(=O)[O-])C=C2)C=C1.[Na+]
MNX internals
InChI (mnx)InChI=1/C14H14N2O4S.Na/c15-10-1-5-12(6-2-10)21(19,20)13-7-3-11(4-8-13)16-9-14(17)18;/h1-8,16H,9,15H2,(H,17,18);/q;+1 Image of MNXM39991
SMILES (mnx)[CH:1]1=[CH:5][C:12]([S:21]([C:13]2=[CH:8][CH:4]=[C:11]([NH:16][CH2:9][C:14](=[O:17])[OH:18])[CH:3]=[CH:7]2)(=[O:19])=[O:20])=[CH:6][CH:2]=[C:10]1[NH2:15].[Na+:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

kegg.drug:D07061
keggD:D07061
GPNYXGDUKNYCNI-UHFFFAOYSA-M
Acediasulfone sodium (INN)
Dermac jabon (TN)

keggD:M_D07061
secondary/obsolete/fantasy identifier