Vitas-M small molecule compound
N-{4-[(2-methoxy-5-{(Z)-[1-(3-methoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}benzyl)oxy]phenyl}acetamide
Catalog ID
STK533876
SMILES COc1cccc(c1)N1C(=S)NC(=O)/C(=C/c2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)/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 C28H25N3O6S MW 531.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O6S/c1-17(32)29-20-8-10-22(11-9-20)37-16-19-13-18(7-12-25(19)36-3)14-24-26(33)30-28(38)31(27(24)34)21-5-4-6-23(15-21)35-2/h4-15H,16H2,1-3H3,(H,29,32)(H,30,33,38)/b24-14-InChIKey
VFPYPEPMGMLHQG-OYKKKHCWSA-NSynonyms
(Z)N(4((2methoxy5((1(3methoxyphenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)benzyl)oxy)phenyl)acetamide
CC(=O)NC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)OC)OC
COc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)C1=O
InChI=1SC28H25N3O6Sc117(32)292081022(11920)3716191318(71225(19)363)142426(33)3028(38)31(27(24)34)2154623(1521)352h415H16H213H3(H2932)(H303338)b2414
MFCD01958216
N(4((2methoxy5((Z)(1(3methoxyphenyl)46dioxo2sulfanylidene13diazinan5ylidene)methyl)phenyl)methoxy)phenyl)acetamide
N(4((2methoxy5((Z)(1(3methoxyphenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)benzyl)oxy)phenyl)acetamide
ZINC000100369226
ZINC100369226
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.