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(Z)-2-(indol-3-yl)-1-thioacetohydroximate

PropertiesImage
MNX_IDMNXM5185 Image of MNXM5185
referencechebi:187899
formulaC10H9N2OS
global charge-1
mol weight205.262
InChIKeyNPTAQBFHUNRJAR-UHFFFAOYSA-M
InChIInChI=1S/C10H10N2OS/c13-12-10(14)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11,13H,5H2,(H,12,14)/p-1
SMILESO/N=C(\[S-])CC1=CNC2=C1C=CC=C2
MNX internals
InChI (mnx)InChI=1/C10H10N2OS/c13-12-10(14)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11,13H,5H2,(H,12,14) Image of MNXM5185
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:9]2[C:8](=[CH:3]1)[C:7]([CH2:5][C:10](=[N:12][OH:13])[SH:14])=[CH:6][NH:11]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:187899
chebi:187899
NPTAQBFHUNRJAR-UHFFFAOYSA-M 		(Z)-2-(indol-3-yl)-1-thioacetohydroximate

CHEBI:136432
chebi:136432
NPTAQBFHUNRJAR-UHFFFAOYSA-M 		(E)-2-(indol-3-yl)-1-thioacetohydroximate
(1E)-2-(1H-indol-3-yl)ethanehydroximothioate
indolylmethylthiohydroximate

CHEBI:137211
chebi:137211
NPTAQBFHUNRJAR-UHFFFAOYSA-N 		(E)-2-(indol-3-yl)-1-thioacetohydroximic acid
(1E)-2-(1H-indol-3-yl)ethanehydroximothioic acid
(E)-2-(1H-indol-3-yl)-1-thioacetohydroximic acid
N-hydroxy(1H-indol-3-yl)ethanethioamide
indolylmethylthiohydroximic acid

metacyc.compound:CPD-1861
metacycM:CPD-1861
NPTAQBFHUNRJAR-UHFFFAOYSA-M 		(Z)-2-(1H-indol-3-yl)-1-thioacetohydroximate

CHEBI:80544
chebi:80544
NPTAQBFHUNRJAR-UHFFFAOYSA-N 		Indolylmethylthiohydroximate

kegg.compound:C16516
keggC:C16516
NPTAQBFHUNRJAR-UHFFFAOYSA-N 		Indolylmethylthiohydroximate
(E)-2-(1H-Indol-3-yl)-1-thioacetohydroximate

seed.compound:cpd16332
seedM:cpd16332
NPTAQBFHUNRJAR-UHFFFAOYSA-M 		Indolylmethylthiohydroximate
(E)-2-(1H-indol-3-yl)-1-thioacetohydroximate
indolylmethylthiohydroximate
indolylmethylthiohydroximic acid

keggC:M_C16516
seedM:M_cpd16332 		secondary/obsolete/fantasy identifier