Vitas-M small molecule compound
4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl 4-chlorobenzoate
Catalog ID
STK401789
SMILES O=C(c1ccc(cc1)Cl)Oc1ccc(cc1)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 C18H11ClN2O5 MW 370.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11ClN2O5/c19-12-5-3-11(4-6-12)17(24)26-13-7-1-10(2-8-13)9-14-15(22)20-18(25)21-16(14)23/h1-9H,(H2,20,21,22,23,25)InChIKey
ZQWRXWDDUSKASY-UHFFFAOYSA-NSynonyms
(4((246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENYL)4CHLOROBENZOATE
4((246TRIOXO13DIHYDROPYRIMIDIN5YLIDENE)METHYL)PHENYL4CHLOROBENZOATE
4((246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenyl4chlorobenzoate
C1=CC(=CC=C1C=C2C(=O)NC(=O)NC2=O)OC(=O)C3=CC=C(C=C3)Cl
InChI=1SC18H11ClN2O5c19125311(4612)17(24)26137110(2813)91415(22)2018(25)2116(14)23h19H(H22021222325)
MFCD00644745
ZINC000002950282
ZINC02950282
ZINC2950282
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