Vitas-M small molecule compound

Catalog ID
STL041195
SMILES O=S(=O)(c1cccc2c1nsn2)/N=c/1\[nH]c2ccccc2nc1Nc1ccc2c(c1)OCCO2

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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 C22H16N6O4S2 MW 492.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N6O4S2/c29-34(30,19-7-3-6-16-20(19)27-33-26-16)28-22-21(24-14-4-1-2-5-15(14)25-22)23-13-8-9-17-18(12-13)32-11-10-31-17/h1-9,12H,10-11H2,(H,23,24)(H,25,28)
InChIKey
WBVQVCGNSSQWDQ-UHFFFAOYSA-N
Synonyms
1009191-17-6
1009191176
MFCD05731286
O=S(=O)(c1cccc2c1nsn2)N=c1(nH)c2ccccc2nc1Nc1ccc2c(c1)OCCO2
ZINC000002604440

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Available files

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