CHEBI:107560 - 1-(4-methoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]thiourea

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ChEBI Name 1-(4-methoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]thiourea
ChEBI ID CHEBI:107560
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H13N3O2S2
Net Charge 0
Average Mass 307.394
Monoisotopic Mass 307.04492
InChI InChI=1S/C13H13N3O2S2/c1-18-10-6-4-9(5-7-10)14-13(19)16-15-12(17)11-3-2-8-20-11/h2-8H,1H3,(H,15,17)(H2,14,16,19)
InChIKey CDMJIFSWLUXAQT-UHFFFAOYSA-N
SMILES COC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=CS2
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1-(4-methoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]thiourea (CHEBI:107560) is a methoxybenzenes (CHEBI:51683)
1-(4-methoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]thiourea (CHEBI:107560) is a substituted aniline (CHEBI:48975)
Manual Xref Database
LSM-18916 LINCS
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