Vitas-M small molecule compound

methyl (3-{(Z)-[1-(3-ethoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetate

Catalog ID
STK176637
SMILES CCOc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CC(=O)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 C24H21N3O6 MW 447.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O6/c1-3-33-17-8-6-7-16(12-17)27-23(30)19(22(29)25-24(27)31)11-15-13-26(14-21(28)32-2)20-10-5-4-9-18(15)20/h4-13H,3,14H2,1-2H3,(H,25,29,31)/b19-11-
InChIKey
RZWNSWDFAWVZAL-ODLFYWEKSA-N
Synonyms

(Z)methyl2(3((1(3ethoxyphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)acetate
CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)OC)C(=O)NC2=O
CCOc1cccc(c1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)OC)C1=O
InChI=1SC24H21N3O6c13331786716(1217)2723(30)19(22(29)2524(27)31)11151326(1421(28)322)201054918(15)20h413H314H212H3(H252931)b1911
METHYL(3((Z)(1(3ETHOXYPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HINDOL1YL)ACETATE
METHYL(3((Z)(1(3ETHOXYPHENYL)4HYDROXY26DIOXO16DIHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HINDOL1YL)ACETATE
METHYL2(3((Z)(1(3ETHOXYPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETATE
MFCD02904886
ZINC09310030
ZINC9310030

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.