Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 2-(thiophen-2-yl)quinoline-4-carboxylate

Catalog ID
STK275215
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])COC(=O)c1cc(nc2c1cccc2)c1cccs1

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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 C22H14N2O5S MW 418.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O5S/c25-20(14-7-9-15(10-8-14)24(27)28)13-29-22(26)17-12-19(21-6-3-11-30-21)23-18-5-2-1-4-16(17)18/h1-12H,13H2
InChIKey
LCAFZKLPQFWFAO-UHFFFAOYSA-N
Synonyms
436829-02-6
(2(4NITROPHENYL)2OXOETHYL)2THIOPHEN2YLQUINOLINE4CARBOXYLATE
2(4nitrophenyl)2oxoethyl2(thiophen2yl)quinoline4carboxylate
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
O=C(c1ccc(cc1)(N+)(=O)(O))COC(=O)c1cc(nc2c1cccc2)c1cccs1
Registry IDs
MFCD03274182
ZINC000002323814
ZINC02323814
ZINC2323814

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Available files

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