Vitas-M small molecule compound
N-[2-(6-{(Z)-[2-hydroxy-4,6-dioxo-1-(2,4,6-trimethylphenyl)-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylacetamide
Catalog ID
STL513705
SMILES COc1c(/C=C\2/C(=O)N=C(N(C2=O)c2c(C)cc(cc2C)C)O)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 C27H29N3O7 MW 507.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O7/c1-14-9-15(2)22(16(3)10-14)30-26(33)20(25(32)28-27(30)34)12-19-18(7-8-29(5)17(4)31)11-21-24(23(19)35-6)37-13-36-21/h9-12H,7-8,13H2,1-6H3,(H,28,32,34)/b20-12-InChIKey
OXJLXKGNKOTTCB-NDENLUEZSA-NSynonyms
858762-32-0~(N)(2(7methoxy6((~(Z))(246trioxo1(246trimethylphenyl)13diazinan5ylidene)methyl)13benzodioxol5yl)ethyl)~(N)methylacetamide
1754157
858762320
InChI=1SC27H29N3O7c114915(2)22(16(3)1014)3026(33)20(25(32)2827(30)34)121918(7829(5)17(4)31)112124(23(19)356)37133621h912H7813H216H3(H283234)b2012
MFCD03266469
N(2(6((Z)(2hydroxy46dioxo1(246trimethylphenyl)16dihydropyrimidin5(4H)ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)Nmethylacetamide
N(2(7METHOXY6((Z)(246TRIOXO1(246TRIMETHYLPHENYL)13DIAZINAN5YLIDENE)METHYL)13BENZODIOXOL5YL)ETHYL)NMETHYLACETAMIDE
ZINC000012662607
ZINC12662607
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