Vitas-M small molecule compound
methyl 4-[(3E)-3-[hydroxy(4-methylphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Catalog ID
STL049072
SMILES COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1noc(c1)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 C24H20N2O6 MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O6/c1-13-4-6-16(7-5-13)21(27)19-20(15-8-10-17(11-9-15)24(30)31-3)26(23(29)22(19)28)18-12-14(2)32-25-18/h4-12,20,27H,1-3H3/b21-19+InChIKey
NXPXXPYWZJRFKU-XUTLUUPISA-NSynonyms
618874-23-0618874230
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NOC(=C3)C)C4=CC=C(C=C4)C(=O)OC)O
COC(=O)c1ccc(cc1)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1noc(c1)C
InChI=1SC24H20N2O6c1134616(7513)21(27)1920(1581017(11915)24(30)313)26(23(29)22(19)28)181214(2)322518h4122027H13H3b2119+
methyl4((3E)3(hydroxy(4methylphenyl)methylidene)1(5methyl12oxazol3yl)45dioxopyrrolidin2yl)benzoate
METHYL4(4HYDROXY1(5METHYLISOXAZOL3YL)3((4METHYLPHENYL)CARBONYL)5OXO3PYRROLIN2YL)BENZOATE
MFCD05730782
ZINC000102885333
ZINC000102885335
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