Vitas-M small molecule compound

3-[(3-chlorobenzyl)sulfanyl]-4-ethyl-5-methyl-4H-1,2,4-triazole

Catalog ID
STK475899
SMILES CCn1c(SCc2cccc(c2)Cl)nnc1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H14ClN3S MW 267.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN3S/c1-3-16-9(2)14-15-12(16)17-8-10-5-4-6-11(13)7-10/h4-7H,3,8H2,1-2H3
InChIKey
HNAXYNIEQAJQRJ-UHFFFAOYSA-N
Synonyms

3((3chlorobenzyl)sulfanyl)4ethyl5methyl4H124triazole
3((3CHLOROPHENYL)METHYLSULFANYL)4ETHYL5METHYL124TRIAZOLE
5((3CHLOROPHENYL)METHYLTHIO)4ETHYL3METHYL124TRIAZOLE
CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)C
InChI=1SC12H14ClN3Sc13169(2)141512(16)1781054611(13)710h47H38H212H3
MFCD05123924
ZINC000006731142
ZINC06731142
ZINC6731142

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Available files

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