Vitas-M small molecule compound

(5E)-1-(furan-2-ylmethyl)-5-{[1-(naphthalen-1-ylmethyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK058765
SMILES O=C1NC(=O)N(C(=O)/C/1=C/c1cccn1Cc1cccc2c1cccc2)Cc1ccco1

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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 C25H19N3O4 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O4/c29-23-22(24(30)28(25(31)26-23)16-20-10-5-13-32-20)14-19-9-4-12-27(19)15-18-8-3-7-17-6-1-2-11-21(17)18/h1-14H,15-16H2,(H,26,29,31)/b22-14+
InChIKey
NIPISIWQTTWNII-HYARGMPZSA-N
Synonyms

(5E)1(FURAN2YLMETHYL)5((1(NAPHTHALEN1YLMETHYL)1HPYRROL2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5E)1(FURAN2YLMETHYL)5((1(NAPHTHALEN1YLMETHYL)PYRROL2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)3(FURAN2YLMETHYL)6HYDROXY5((1(NAPHTHALEN1YLMETHYL)1HPYRROL2YL)METHYLIDENE)PYRIMIDINE24(3H5H)DIONE
(Z)1(furan2ylmethyl)5((1(naphthalen1ylmethyl)1Hpyrrol2yl)methylene)pyrimidine246(1H3H5H)trione
C1=CC=C2C(=C1)C=CC=C2CN3C=CC=C3C=C4C(=O)NC(=O)N(C4=O)CC5=CC=CO5
InChI=1SC25H19N3O4c292322(24(30)28(25(31)2623)1620105133220)1419941227(19)1518837176121121(17)18h114H1516H2(H262931)b2214+
MFCD08051447
O=C1NC(=O)N(C(=O)C1=Cc1cccn1Cc1cccc2c1cccc2)Cc1ccco1
STK058765
ZINC9136053

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Available files

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