Vitas-M small molecule compound

4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK444601
SMILES Cc1nnc(n1c1ccccc1Cl)S

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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 C9H8ClN3S MW 225.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8ClN3S/c1-6-11-12-9(14)13(6)8-5-3-2-4-7(8)10/h2-5H,1H3,(H,12,14)
InChIKey
LUQHKHZFLFXGMZ-UHFFFAOYSA-N
Synonyms
52747-59-8
3H124TRIAZOLE3THIONE4(2CHLOROPHENYL)24DIHYDRO5METHYL
4(2chlorophenyl)3methyl1H124triazole5thione
4(2CHLOROPHENYL)5METHYL124TRIAZOLE3THIOL
4(2chlorophenyl)5methyl4H124triazole3thiol
52747598
CC1=NNC(=S)N1C2=CC=CC=C2Cl
InChI=1SC9H8ClN3Sc1611129(14)13(6)853247(8)10h25H1H3(H1214)
MFCD04057451
ZINC000006790247
ZINC6790247

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.