Vitas-M small molecule compound

5-benzyl-3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK876268
SMILES CSc1nnc2c(n1)n(Cc1ccccc1)c1c2cccc1

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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 C17H14N4S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4S/c1-22-17-18-16-15(19-20-17)13-9-5-6-10-14(13)21(16)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey
BOKIJEQYJIVZPJ-UHFFFAOYSA-N
Synonyms
827011-68-7
5benzyl3(methylsulfanyl)5H(124)triazino(56b)indole
5BENZYL3(METHYLTHIO)5H(124)TRIAZINO(56B)INDOLE
5BENZYL3METHYLSULFANYL(124)TRIAZINO(56B)INDOLE
827011687
CSC1=NC2=C(C3=CC=CC=C3N2CC4=CC=CC=C4)N=N1
InChI=1SC17H14N4Sc12217181615(192017)139561014(13)21(16)11127324812h210H11H21H3
MFCD02586702
ZINC000002871835
ZINC02871835
ZINC2871835

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Available files

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