CHEBI:108959 - (3-bromo-4-methoxyphenyl)-(4-methyl-1-piperazinyl)methanethione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (3-bromo-4-methoxyphenyl)-(4-methyl-1-piperazinyl)methanethione
ChEBI ID CHEBI:108959
Stars This entity has been manually annotated by a third party.
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Formula C13H17BrN2OS
Net Charge 0
Average Mass 329.257
Monoisotopic Mass 328.02450
InChI InChI=1S/C13H17BrN2OS/c1-15-5-7-16(8-6-15)13(18)10-3-4-12(17-2)11(14)9-10/h3-4,9H,5-8H2,1-2H3
InChIKey ZTDROPBNMRZUIS-UHFFFAOYSA-N
SMILES CN1CCN(CC1)C(=S)C2=CC(=C(C=C2)OC)Br
ChEBI Ontology
Outgoing (3-bromo-4-methoxyphenyl)-(4-methyl-1-piperazinyl)methanethione (CHEBI:108959) is a methoxybenzenes (CHEBI:51683)
Manual Xref Database
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