Vitas-M small molecule compound
[4-{(E)-[1-(4-ethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxy-6-(prop-2-en-1-yl)phenoxy]acetic acid
Catalog ID
STL495859
SMILES C=CCc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)CC)cc(c1OCC(=O)O)OC
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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 C25H24N2O7 MW 464.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O7/c1-4-6-17-11-16(13-20(33-3)22(17)34-14-21(28)29)12-19-23(30)26-25(32)27(24(19)31)18-9-7-15(5-2)8-10-18/h4,7-13H,1,5-6,14H2,2-3H3,(H,28,29)(H,26,30,32)/b19-12+InChIKey
OPFGBABHBNXJGP-XDHOZWIPSA-NSynonyms
(4((E)(1(4ethylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)2methoxy6(prop2en1yl)phenoxy)aceticacid
2(4((E)(1(4ETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXY6PROP2ENYLPHENOXY)ACETICACID
C=CCc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)CC)cc(c1OCC(=O)O)OC
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OCC(=O)O)CC=C)C(=O)NC2=O
InChI=1SC25H24N2O7c146171116(1320(333)22(17)341421(28)29)121923(30)2625(32)27(24(19)31)189715(52)81018h4713H15614H223H3(H2829)(H263032)b1912+
MFCD02624363
ZINC000027532571
ZINC27532571
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