Vitas-M small molecule compound

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

Catalog ID
STL236393
SMILES Oc1nc(SCCc2ccccc2)nnc1c1ccccc1

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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 C17H15N3OS MW 309.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3OS/c21-16-15(14-9-5-2-6-10-14)19-20-17(18-16)22-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,18,20,21)
InChIKey
ZCSOEWCPEMCTEX-UHFFFAOYSA-N
Synonyms
912899-60-6
3(phenethylthio)6phenyl124triazin5ol
6phenyl3((2phenylethyl)sulfanyl)124triazin5ol
6phenyl3(2phenylethylsulfanyl)2H124triazin5one
6PHENYL3(2PHENYLETHYLTHIO)4H124TRIAZIN5ONE
912899606
C1=CC=C(C=C1)CCSC2=NC(=O)C(=NN2)C3=CC=CC=C3
InChI=1SC17H15N3OSc211615(1495261014)192017(1816)221211137314813h110H1112H2(H182021)
MFCD08745780
ZINC000009184405
ZINC9184405

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Available files

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