Vitas-M small molecule compound

Catalog ID
STL052011
SMILES COc1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc2c1nsn2

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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 C21H16N6O3S2 MW 464.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N6O3S2/c1-30-14-7-4-6-13(12-14)22-20-21(24-16-9-3-2-8-15(16)23-20)27-32(28,29)18-11-5-10-17-19(18)26-31-25-17/h2-12H,1H3,(H,22,23)(H,24,27)
InChIKey
VYFLMWHFABIHID-UHFFFAOYSA-N
Synonyms
1001785-56-3
1001785563
COc1cccc(c1)Nc1nc2ccccc2(nH)c1=NS(=O)(=O)c1cccc2c1nsn2
MFCD05734839
ZINC000002555014

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Available files

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