Vitas-M small molecule compound

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

Catalog ID
STK448644
SMILES CCOc1ccccc1c1nnc(n1C)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 C11H13N3OS MW 235.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3OS/c1-3-15-9-7-5-4-6-8(9)10-12-13-11(16)14(10)2/h4-7H,3H2,1-2H3,(H,13,16)
InChIKey
BKLGQMGJSHHOCE-UHFFFAOYSA-N
Synonyms
725245-13-6
3(2ethoxyphenyl)4methyl1H124triazole5thione
5(2ETHOXYPHENYL)4METHYL124TRIAZOLE3THIOL
5(2ETHOXYPHENYL)4METHYL24DIHYDRO(124)TRIAZOLE3THIONE
5(2ethoxyphenyl)4methyl4H124triazole3thiol
725245136
CCOC1=CC=CC=C1C2=NNC(=S)N2C
InChI=1SC11H13N3OSc1315975468(9)10121311(16)14(10)2h47H3H212H3(H1316)
MFCD04968869
ZINC000002536712
ZINC02536712
ZINC2536712

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Available files

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