Vitas-M small molecule compound

propyl 2-methyl-4-(5-methylfuran-2-yl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK403117
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(o1)C)C(=O)CC(C2)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 C23H25NO4S MW 411.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO4S/c1-4-9-27-23(26)20-14(3)24-16-11-15(19-6-5-10-29-19)12-17(25)21(16)22(20)18-8-7-13(2)28-18/h5-8,10,15,22,24H,4,9,11-12H2,1-3H3
InChIKey
TXFJGMHPLNJGHE-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(NC2=C(C1C3=CC=C(O3)C)C(=O)CC(C2)C4=CC=CS4)C
InChI=1SC23H25NO4Sc1492723(26)2014(3)24161115(1965102919)1217(25)21(16)22(20)188713(2)2818h5810152224H491112H213H3
MFCD03146466
propyl2methyl4(5methylfuran2yl)5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
propyl2methyl4(5methylfuran2yl)5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
ZINC000002735283
ZINC000002735286

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Available files

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