Vitas-M small molecule compound
ethyl 3-(3-{(Z)-[1-(3,4-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK608578
SMILES CCOC(=O)c1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)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 C28H27N3O5 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O5/c1-6-36-27(34)20-8-7-9-22(14-20)30-18(4)13-21(19(30)5)15-24-25(32)29-28(35)31(26(24)33)23-11-10-16(2)17(3)12-23/h7-15H,6H2,1-5H3,(H,29,32,35)/b24-15-InChIKey
WBWCGUYIZBLOIX-IWIPYMOSSA-NSynonyms
CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC(=C(C=C4)C)C)C
CCOC(=O)c1cccc(c1)n1c(C)cc(c1C)C=C1C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O
ETHYL3(3((Z)(1(34DIMETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)25DIMETHYLPYRROL1YL)BENZOATE
ethyl3(3((Z)(1(34dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)25dimethyl1Hpyrrol1yl)benzoate
InChI=1SC28H27N3O5c163627(34)2087922(1420)3018(4)1321(19(30)5)152425(32)2928(35)31(26(24)33)23111016(2)17(3)1223h715H6H215H3(H293235)b2415
MFCD08734494
ZINC000013810161
ZINC13810161
Check stock
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