Vitas-M small molecule compound
2-methoxy-4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl 2-chlorobenzoate
Catalog ID
STK408964
SMILES COc1cc(ccc1OC(=O)c1ccccc1Cl)C=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 C19H13ClN2O6 MW 400.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O6/c1-27-15-9-10(8-12-16(23)21-19(26)22-17(12)24)6-7-14(15)28-18(25)11-4-2-3-5-13(11)20/h2-9H,1H3,(H2,21,22,23,24,26)InChIKey
OGCCZAPPZVLJDF-UHFFFAOYSA-NSynonyms
(2methoxy4((246trioxo13diazinan5ylidene)methyl)phenyl)2chlorobenzoate
2METHOXY4((246TRIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)PHENYL2CHLOROBENZOATE
2methoxy4((246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenyl2chlorobenzoate
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)NC2=O)OC(=O)C3=CC=CC=C3Cl
InChI=1SC19H13ClN2O6c12715910(81216(23)2119(26)2217(12)24)6714(15)2818(25)11423513(11)20h29H1H3(H22122232426)
MFCD00654856
ZINC000003040818
ZINC03040818
ZINC3040818
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