Vitas-M small molecule compound

9-(4-ethoxyphenyl)-1,7-dimethyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL005841
SMILES C=CCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)OCC

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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 C21H25N5O3 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3/c1-5-11-24-19(27)17-18(23(4)21(24)28)22-20-25(12-14(3)13-26(17)20)15-7-9-16(10-8-15)29-6-2/h5,7-10,14H,1,6,11-13H2,2-4H3
InChIKey
YOMYBYWWPOHRBV-UHFFFAOYSA-N
Synonyms
847268-82-0
3allyl9(4ethoxyphenyl)17dimethyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
847268820
9(4ethoxyphenyl)17dimethyl3(prop2en1yl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
9(4ETHOXYPHENYL)17DIMETHYL3PROP2ENYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
CCOC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC=C)C
InChI=1SC21H25N5O3c15112419(27)1718(23(4)21(24)28)222025(1214(3)1326(17)20)157916(10815)2962h571014H161113H224H3
MFCD04178878
ZINC000005156711
ZINC000005156713

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Available files

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