Vitas-M small molecule compound

3-[(3-methylbutyl)sulfanyl]-6-phenyl-1,2,4-triazin-5-ol

Catalog ID
STK630148
SMILES CC(CCSc1nnc(c(n1)O)c1ccccc1)C

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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 C14H17N3OS MW 275.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3OS/c1-10(2)8-9-19-14-15-13(18)12(16-17-14)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,15,17,18)
InChIKey
JRJLIZAAFKUVDJ-UHFFFAOYSA-N
Synonyms
912907-22-3
3((3methylbutyl)sulfanyl)6phenyl124triazin5ol
3(3methylbutylsulfanyl)6phenyl2H124triazin5one
3(3METHYLBUTYLTHIO)6PHENYL4H124TRIAZIN5ONE
3(isopentylthio)6phenyl124triazin5ol
912907223
CC(C)CCSC1=NC(=O)C(=NN1)C2=CC=CC=C2
InChI=1SC14H17N3OSc110(2)8919141513(18)12(161714)116435711h3710H89H212H3(H151718)
MFCD08746977
ZINC000009305130
ZINC9305130

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Available files

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