Vitas-M small molecule compound

methyl 4-[2-(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)hydrazinyl]benzoate

Catalog ID
STK732041
SMILES COC(=O)c1ccc(cc1)NN=C1C(=O)NC(=O)NC1=O

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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 C12H10N4O5 MW 290.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O5/c1-21-11(19)6-2-4-7(5-3-6)15-16-8-9(17)13-12(20)14-10(8)18/h2-5,15H,1H3,(H2,13,14,17,18,20)
InChIKey
ZSKREZJJCSQRKM-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NN=C2C(=O)NC(=O)NC2=O
InChI=1SC12H10N4O5c12111(19)6247(536)151689(17)1312(20)1410(8)18h2515H1H3(H21314171820)
METHYL4(2(246TRIOXO13DIAZINAN5YLIDENE)HYDRAZINYL)BENZOATE
methyl4(2(246trioxotetrahydropyrimidin5(2H)ylidene)hydrazinyl)benzoate
MFCD00746506
ZINC000017748564
ZINC17748564

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Available files

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