Vitas-M small molecule compound

2-methyl-4-(naphthalen-2-ylsulfanyl)[1]benzofuro[3,2-d]pyrimidine

Catalog ID
STL003803
SMILES Cc1nc(Sc2ccc3c(c2)cccc3)c2c(n1)c1ccccc1o2

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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 C21H14N2OS MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2OS/c1-13-22-19-17-8-4-5-9-18(17)24-20(19)21(23-13)25-16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3
InChIKey
AXYVZUYPJWTVCR-UHFFFAOYSA-N
Synonyms
845660-65-3
2methyl4(naphthalen2ylsulfanyl)(1)benzofuro(32d)pyrimidine
2methyl4(naphthalen2ylthio)benzofuro(32d)pyrimidine
2METHYL4NAPHTHALEN2YLSULFANYL(1)BENZOFURO(32D)PYRIMIDINE
845660653
CC1=NC2=C(C(=N1)SC3=CC4=CC=CC=C4C=C3)OC5=CC=CC=C52
InChI=1SC21H14N2OSc113221917845918(17)2420(19)21(2313)2516111014623715(14)1216h212H1H3
MFCD04168194
ZINC000005180155
ZINC05180155
ZINC5180155

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Available files

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