Vitas-M small molecule compound
N-(2-{7-methoxy-6-[(Z)-(2,4,6-trioxo-1-phenyltetrahydropyrimidin-5(2H)-ylidene)methyl]-1,3-benzodioxol-5-yl}ethyl)-N-methylacetamide
Catalog ID
STL513540
SMILES COc1c(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccccc2)c(CCN(C(=O)C)C)cc2c1OCO2
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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 C24H23N3O7 MW 465.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O7/c1-14(28)26(2)10-9-15-11-19-21(34-13-33-19)20(32-3)17(15)12-18-22(29)25-24(31)27(23(18)30)16-7-5-4-6-8-16/h4-8,11-12H,9-10,13H2,1-3H3,(H,25,29,31)/b18-12-InChIKey
CTNCPPCSUYJRJE-PDGQHHTCSA-NSynonyms
~(N)(2(7methoxy6((~(Z))(246trioxo1phenyl13diazinan5ylidene)methyl)13benzodioxol5yl)ethyl)~(N)methylacetamide
1745324
COc1c(C=C2C(=O)NC(=O)N(C2=O)c2ccccc2)c(CCN(C(=O)C)C)cc2c1OCO2
InChI=1SC24H23N3O7c114(28)26(2)10915111921(34133319)20(323)17(15)121822(29)2524(31)27(23(18)30)167546816h481112H91013H213H3(H252931)b1812
MFCD03006317
N(2(7methoxy6((246trioxo1phenyltetrahydropyrimidin5(2H)ylidene)methyl)benzo(d)(13)dioxol5yl)ethyl)Nmethylacetamide
N(2(7METHOXY6((Z)(246TRIOXO1PHENYL13DIAZINAN5YLIDENE)METHYL)13BENZODIOXOL5YL)ETHYL)NMETHYLACETAMIDE
N(2(7methoxy6((Z)(246trioxo1phenyltetrahydropyrimidin5(2H)ylidene)methyl)13benzodioxol5yl)ethyl)Nmethylacetamide
ZINC000009046220
ZINC9046220
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