Vitas-M small molecule compound

ethyl 2-amino-4-(3-iodophenyl)-5-oxo-4H,5H-pyrano[2,3-b]chromene-3-carboxylate

Catalog ID
STK956627
SMILES CCOC(=O)C1=C(N)Oc2c(C1c1cccc(c1)I)c(=O)c1c(o2)cccc1

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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 C21H16INO5 MW 489.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16INO5/c1-2-26-20(25)17-15(11-6-5-7-12(22)10-11)16-18(24)13-8-3-4-9-14(13)27-21(16)28-19(17)23/h3-10,15H,2,23H2,1H3
InChIKey
ZGRXSRIJDPBLDM-UHFFFAOYSA-N
Synonyms
438605-76-6
438605766
CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC=C3)I)C(=O)C4=CC=CC=C4O2)N
ethyl2amino4(3iodophenyl)5oxo4H5Hpyrano(23b)chromene3carboxylate
ETHYL2AMINO4(3IODOPHENYL)5OXO4HPYRANO(23B)CHROMENE3CARBOXYLATE
InChI=1SC21H16INO5c122620(25)1715(1165712(22)1011)1618(24)13834914(13)2721(16)2819(17)23h31015H223H21H3
MFCD00730920
ZINC000002765432
ZINC000002765433

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Available files

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