Vitas-M small molecule compound

3-[2-(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)hydrazinyl]benzenesulfonate

Catalog ID
STK329367
SMILES O=C1NC(=O)C(=NNc2cccc(c2)S(=O)(=O)[O-])C(=O)N1

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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 C10H7N4O6S MW 311.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8N4O6S/c15-8-7(9(16)12-10(17)11-8)14-13-5-2-1-3-6(4-5)21(18,19)20/h1-4,13H,(H,18,19,20)(H2,11,12,15,16,17)/p-1
InChIKey
ISSTUQUWIDJNOW-UHFFFAOYSA-M
Synonyms

3(2(246trioxo13diazinan5ylidene)hydrazinyl)benzenesulfonate
3(2(246trioxotetrahydropyrimidin5(2H)ylidene)hydrazinyl)benzenesulfonate
C1=CC(=CC(=C1)S(=O)(=O)(O))NN=C2C(=O)NC(=O)NC2=O
InChI=1SC10H8N4O6Sc1587(9(16)1210(17)118)141352136(45)21(1819)20h1413H(H181920)(H21112151617)p1
MFCD09961869
O=C1NC(=O)C(=NNc2cccc(c2)S(=O)(=O)(O))C(=O)N1
ZINC000018191801

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Available files

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