Vitas-M small molecule compound

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

Catalog ID
STK472630
SMILES Cc1cccc(c1)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 C11H13N3S MW 219.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3S/c1-9-4-3-5-10(6-9)7-15-11-13-12-8-14(11)2/h3-6,8H,7H2,1-2H3
InChIKey
NNAFHVSSBUZZHX-UHFFFAOYSA-N
Synonyms

4methyl3((3methylbenzyl)sulfanyl)4H124triazole
4METHYL3((3METHYLPHENYL)METHYLSULFANYL)124TRIAZOLE
4METHYL3((3METHYLPHENYL)METHYLTHIO)124TRIAZOLE
CC1=CC(=CC=C1)CSC2=NN=CN2C
InChI=1SC11H13N3Sc1943510(69)715111312814(11)2h368H7H212H3
MFCD03341011
ZINC000006317275
ZINC06317275
ZINC6317275

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Available files

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