Vitas-M small molecule compound

Catalog ID
STK990729
SMILES COc1ccc(cc1)CCn1c[nH]c2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccs1

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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 C26H21N6O2S MW 481.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N6O2S/c1-34-18-10-8-17(9-11-18)12-13-31-16-27-24-22(26(31)33)23-25(30-21-7-3-2-6-20(21)29-23)32(24)28-15-19-5-4-14-35-19/h2-11,14-16H,12-13H2,1H3,(H,27,33)/b28-15+
InChIKey
OEJZRRLFFJEYDH-RWPZCVJISA-N
Synonyms

COc1ccc(cc1)CCn1c(nH)c2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccs1
MFCD18184589

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Available files

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