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ethionamide S-oxide

Properties

Image

Occurences in reactions

MNX_ID

MNXM511853

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	1

formula

C₈H₁₀N₂OS

charge

mass

182.05138

reference

InChIKey

QDQQNGZRIJPDGA-UHFFFAOYSA-N

InChI

InChI=1S/C8H10N2OS/c1-2-7-5-6(3-4-10-7)8(9)12-11/h3-5H,2,9H2,1H3

SMILES

CCc1cc(C(N)=S=O)ccn1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:87805 chebi:87805	ethionamide S-oxide 1-(2-ethylpyridin-4-yl)-1-(oxo-lambda(4)-sulfanylidene)methanamine ethionamide sulfoxide ethionamide sulphoxide
seed.compound:cpd32628 seedM:cpd32628	1-(2-ethylpyridin-4-yl)-1-(oxo-?4-sulfanylidene)methanamine ethionamide S-oxide ethionamide sulfoxide
hmdb:HMDB0060624	Ethionamide sulphoxide (2-ethylpyridin-4-yl)(sulfinylidene)methanamine Ethionamide sulfoxide
sabiork.compound:23177 sabiorkM:23177	Ethionamide-S-oxide
metacyc.compound:CPD-19989 metacycM:CPD-19989	ethionamide S-oxide 1-(2-ethylpyridin-4-yl)-1-(oxo-?4-sulfanylidene)methanamine ethionamide sulfoxide
hmdb:HMDB60624 seedM:M_cpd32628	secondary/obsolete/fantasy identifier