Vitas-M small molecule compound
N-[2-(6-{(Z)-[1-(4-ethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylacetamide
Catalog ID
STL513618
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2c(CCN(C(=O)C)C)cc3c(c2OC)OCO3)/C1=O
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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 C26H27N3O7 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O7/c1-5-16-6-8-18(9-7-16)29-25(32)20(24(31)27-26(29)33)13-19-17(10-11-28(3)15(2)30)12-21-23(22(19)34-4)36-14-35-21/h6-9,12-13H,5,10-11,14H2,1-4H3,(H,27,31,33)/b20-13-InChIKey
YONGPPQOMNDUNM-MOSHPQCFSA-NSynonyms
370584-61-5(Z)N(2(6((1(4ethylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)7methoxybenzo(d)(13)dioxol5yl)ethyl)Nmethylacetamide
~(N)(2(6((~(Z))(1(4ethylphenyl)246trioxo13diazinan5ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)~(N)methylacetamide
16397494
370584615
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2c(CCN(C(=O)C)C)cc3c(c2OC)OCO3)C1=O
InChI=1SC26H27N3O7c15166818(9716)2925(32)20(24(31)2726(29)33)131917(101128(3)15(2)30)122123(22(19)344)36143521h691213H5101114H214H3(H273133)b2013
MFCD03006191
N(2(6((Z)(1(4ethylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)Nmethylacetamide
ZINC000012660604
ZINC12660604
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