Vitas-M small molecule compound
4-{(E)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenyl acetate
Catalog ID
STK171000
SMILES CC(=O)Oc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
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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 C20H16N2O5 MW 364.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5/c1-12-3-7-15(8-4-12)22-19(25)17(18(24)21-20(22)26)11-14-5-9-16(10-6-14)27-13(2)23/h3-11H,1-2H3,(H,21,24,26)/b17-11+InChIKey
JZSOOUGFMUBDME-GZTJUZNOSA-NSynonyms
(4((E)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENYL)ACETATE
4((E)(1(4METHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENYLACETATE
CC(=O)Oc1ccc(cc1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OC(=O)C)C(=O)NC2=O
InChI=1SC20H16N2O5c1123715(8412)2219(25)17(18(24)2120(22)26)11145916(10614)2713(2)23h311H12H3(H212426)b1711+
MFCD06663477
ZINC000004703328
ZINC04703328
ZINC4703328
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