Vitas-M small molecule compound

6-methyl-3-(octylsulfanyl)-1,2,4-triazin-5-ol

Catalog ID
STL350068
SMILES CCCCCCCCSc1nnc(c(n1)O)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 C12H21N3OS MW 255.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H21N3OS/c1-3-4-5-6-7-8-9-17-12-13-11(16)10(2)14-15-12/h3-9H2,1-2H3,(H,13,15,16)
InChIKey
UBFHBTUCSJCBPZ-UHFFFAOYSA-N
Synonyms
912907-24-5
6methyl3(octylsulfanyl)124triazin5ol
6methyl3(octylthio)124triazin5ol
6methyl3octylsulfanyl2H124triazin5one
6METHYL3OCTYLTHIO4H124TRIAZIN5ONE
912907245
CCCCCCCCSC1=NC(=O)C(=NN1)C
InChI=1SC12H21N3OSc1345678917121311(16)10(2)141512h39H212H3(H131516)
MFCD08746518
ZINC000097957225
ZINC97957225

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Available files

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