Vitas-M small molecule compound

2-(cyclohexylamino)-2-oxoethyl 2-chloro-5-{5-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]furan-2-yl}benzoate

Catalog ID
STL367265
SMILES O=C(NC1CCCCC1)COC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

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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 C25H23ClN4O8 MW 542.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O8/c26-18-9-6-14(12-17(18)24(33)37-13-21(31)27-15-4-2-1-3-5-15)20-11-8-16(38-20)7-10-19-22(30(35)36)23(32)29-25(34)28-19/h6-12,15H,1-5,13H2,(H,27,31)(H2,28,29,32,34)/b10-7+
InChIKey
YKPZQMFUYJXCNF-JXMROGBWSA-N
Synonyms

MFCD28951696
O=C(NC1CCCCC1)COC(=O)c1cc(ccc1Cl)c1ccc(o1)C=Cc1nc(O)nc(c1(N+)(=O)(O))O
ZINC000100391776

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Available files

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