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ethionamide S-oxide

PropertiesImage
MNX_IDMNXM511853 Image of MNXM511853
referencechebi:87805
formulaC8H10N2OS
global charge0
mol weight182.248
InChIKeyQDQQNGZRIJPDGA-UHFFFAOYSA-N
InChIInChI=1S/C8H10N2OS/c1-2-7-5-6(3-4-10-7)8(9)12-11/h3-5H,2,9H2,1H3
SMILESCCC1=CC(C(N)=S=O)=CC=N1
MNX internals
InChI (mnx)InChI=1/C8H10N2OS/c1-2-7-5-6(3-4-10-7)8(9)12-11/h3-5H,2,9H2,1H3 Image of MNXM511853
SMILES (mnx)[CH3:1][CH2:2][C:7]1=[N:10][CH:4]=[CH:3][C:6]([C:8]([NH2:9])=[S:12]=[O:11])=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:87805
chebi:87805
QDQQNGZRIJPDGA-UHFFFAOYSA-N 		ethionamide S-oxide
1-(2-ethylpyridin-4-yl)-1-(oxo-lambda(4)-sulfanylidene)methanamine
ethionamide sulfoxide
ethionamide sulphoxide

seed.compound:cpd32628
seedM:cpd32628
QDQQNGZRIJPDGA-UHFFFAOYSA-N 		1-(2-ethylpyridin-4-yl)-1-(oxo-?4-sulfanylidene)methanamine
ethionamide S-oxide
ethionamide sulfoxide
hmdb:HMDB0060624
QDQQNGZRIJPDGA-UHFFFAOYSA-N 		Ethionamide sulphoxide
(2-ethylpyridin-4-yl)(sulfinylidene)methanamine
Ethionamide sulfoxide

sabiork.compound:23177
sabiorkM:23177
QDQQNGZRIJPDGA-UHFFFAOYSA-N 		Ethionamide-S-oxide

metacyc.compound:CPD-19989
metacycM:CPD-19989
QDQQNGZRIJPDGA-UHFFFAOYSA-N 		ethionamide S-oxide
1-(2-ethylpyridin-4-yl)-1-(oxo-?4-sulfanylidene)methanamine
ethionamide sulfoxide

hmdb:HMDB60624
seedM:M_cpd32628 		secondary/obsolete/fantasy identifier