3-(4-chlorophenyl)-5-(methylthio)-4H-1,2,4-triazole (CHEBI:47523)

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CHEBI:47523 - 3-(4-chlorophenyl)-5-(methylthio)-4H-1,2,4-triazole

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ChEBI ID	CHEBI:47523
ChEBI Name	3-(4-chlorophenyl)-5-(methylthio)-4H-1,2,4-triazole
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Downloads	Molfile

Formula	C9H8ClN3S
Net Charge	0
Average Mass	225.704
Monoisotopic Mass	225.01275
SMILES	[H]c1c([H])c(-c2nnc(SC([H])([H])[H])n2[H])c([H])c([H])c1Cl
InChI	InChI=1S/C9H8ClN3S/c1-14-9-11-8(12-13-9)6-2-4-7(10)5-3-6/h2-5H,1H3,(H,11,12,13)
InChIKey	YXVAYMRODBYXIQ-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-(4-chlorophenyl)-5-(methylthio)-4H-1,2,4-triazole (CHEBI:47523) is a unclassifieds (CHEBI:27189)

Synonyms	Source
3-(4-chlorophenyl)-5-(methylsulfanyl)-4H-1,2,4-triazole	PDBeChem
3-(4-chlorophenyl)-5-(methylthio)-4H-1,2,4-triazole	PDBeChem

Manual Xrefs	Databases
L03	PDBeChem