CHEBI:167795 - N2-phenyl-3-methylbenzo[b]thiophene-2-carbothioamide

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name N2-phenyl-3-methylbenzo[b]thiophene-2-carbothioamide
ChEBI ID CHEBI:167795
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H13NS2
Net Charge 0
Average Mass 283.410
Monoisotopic Mass 283.04894
InChI InChI=1S/C16H13NS2/c1-11-13-9-5-6-10-14(13)19-15(11)16(18)17-12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey BHBKNDXQWDKPHA-UHFFFAOYSA-N
SMILES S=C(NC1=CC=CC=C1)C=2SC=3C=CC=CC3C2C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood serum (BTO:0000133). See: MetaboLights Study
ChEBI Ontology
Outgoing N2-phenyl-3-methylbenzo[b]thiophene-2-carbothioamide (CHEBI:167795) is a 1-benzothiophenes (CHEBI:38836)
IUPAC Name
3-methyl-N-phenyl-1-benzothiophene-2-carbothioamide
Manual Xref Database
2102544 ChemSpider
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