Vitas-M small molecule compound

3-(11-acetyl-1,3-dimethyl-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)phenyl acetate

Catalog ID
STK133965
SMILES CC(=O)Oc1cccc(c1)C1C2=C(c3c(C2=O)cccc3)N(c2c1c(=O)n(C)c(=O)n2C)C(=O)C

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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 C26H21N3O6 MW 471.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O6/c1-13(30)29-22-17-10-5-6-11-18(17)23(32)20(22)19(15-8-7-9-16(12-15)35-14(2)31)21-24(29)27(3)26(34)28(4)25(21)33/h5-12,19H,1-4H3
InChIKey
HMJYYRYQXBBCKV-UHFFFAOYSA-N
Synonyms

3(11acetyl13dimethyl246trioxo2345611hexahydro1Hindeno(2156)pyrido(23d)pyrimidin5yl)phenylacetate
CC(=O)N1C2=C(C(C3=C1N(C(=O)N(C3=O)C)C)C4=CC(=CC=C4)OC(=O)C)C(=O)C5=CC=CC=C52
InChI=1SC26H21N3O6c113(30)29221710561118(17)23(32)20(22)19(1587916(1215)3514(2)31)2124(29)27(3)26(34)28(4)25(21)33h51219H14H3
MFCD02242118
ZINC000001451708
ZINC000001451709

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Available files

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