Vitas-M small molecule compound
methyl 4-(7-amino-6-cyano-4-oxo-1,5-dihydro-4H-pyrano[2,3-d]pyrimidin-5-yl)benzoate
Catalog ID
STK775097
SMILES COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c(=O)nc[nH]2)C#N
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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 C16H12N4O4 MW 324.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O4/c1-23-16(22)9-4-2-8(3-5-9)11-10(6-17)13(18)24-15-12(11)14(21)19-7-20-15/h2-5,7,11H,18H2,1H3,(H,19,20,21)InChIKey
OYDHRDMDTVXIDA-UHFFFAOYSA-NSynonyms
BENZOICACID4(7AMINO6CYANO4OXO15DIHYDRO4HPYRANO(23D)PYRIMIDIN5YL)METHYLESTER
COC(=O)C1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)NC=N3)N)C#N
COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c(=O)nc(nH)2)C#N
InChI=1SC16H12N4O4c12316(22)9428(359)1110(617)13(18)241512(11)14(21)1972015h25711H18H21H3(H192021)
METHYL4(7AMINO6CYANO4HYDROXY5HPYRANO(23D)PYRIMIDIN5YL)BENZOATE
methyl4(7amino6cyano4oxo15dihydro4Hpyrano(23d)pyrimidin5yl)benzoate
METHYL4(7AMINO6CYANO4OXO35DIHYDROPYRANO(23D)PYRIMIDIN5YL)BENZOATE
MFCD04061969
ZINC000013471611
ZINC000013471613
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