CHEBI:105997 - 1-(4-bromo-2-chlorophenyl)-3-(3-methyl-2-pyridinyl)thiourea

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(4-bromo-2-chlorophenyl)-3-(3-methyl-2-pyridinyl)thiourea
ChEBI ID CHEBI:105997
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H11BrClN3S
Net Charge 0
Average Mass 356.670
Monoisotopic Mass 354.95456
InChI InChI=1S/C13H11BrClN3S/c1-8-3-2-6-16-12(8)18-13(19)17-11-5-4-9(14)7-10(11)15/h2-7H,1H3,(H2,16,17,18,19)
InChIKey KEAKWJXFKMKZFP-UHFFFAOYSA-N
SMILES CC1=C(N=CC=C1)NC(=S)NC2=C(C=C(C=C2)Br)Cl
ChEBI Ontology
Outgoing 1-(4-bromo-2-chlorophenyl)-3-(3-methyl-2-pyridinyl)thiourea (CHEBI:105997) is a thioureas (CHEBI:51276)
Manual Xref Database
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