Vitas-M small molecule compound

3-[(4-methoxybenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazole

Catalog ID
STK733312
SMILES COc1ccc(cc1)CSc1nncn1C

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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 C11H13N3OS MW 235.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3OS/c1-14-8-12-13-11(14)16-7-9-3-5-10(15-2)6-4-9/h3-6,8H,7H2,1-2H3
InChIKey
YALHKVASCWFATJ-UHFFFAOYSA-N
Synonyms
338987-23-8
3((4methoxybenzyl)sulfanyl)4methyl4H124triazole
3((4methoxybenzyl)thio)4methyl4H124triazole
3((4METHOXYPHENYL)METHYLSULFANYL)4METHYL124TRIAZOLE
338987238
4H(124)TRIAZOLE3(4METHOXYBENZYLSULFANYL)4METHYL
CN1C=NN=C1SCC2=CC=C(C=C2)OC
InChI=1SC11H13N3OSc1148121311(14)16793510(152)649h368H7H212H3
MFCD00737290
ZINC000000546900
ZINC00546900
ZINC546900

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Available files

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