Vitas-M small molecule compound

ethyl 7-(4-fluorophenyl)-2-methyl-4-[4-(morpholin-4-yl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK406056
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N1CCOCC1)C(=O)CC(C2)c1ccc(cc1)F

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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 C29H31FN2O4 MW 490.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31FN2O4/c1-3-36-29(34)26-18(2)31-24-16-21(19-4-8-22(30)9-5-19)17-25(33)28(24)27(26)20-6-10-23(11-7-20)32-12-14-35-15-13-32/h4-11,21,27,31H,3,12-17H2,1-2H3
InChIKey
SPFKMJUUKTXMJA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)N4CCOCC4)C(=O)CC(C2)C5=CC=C(C=C5)F)C
ethyl7(4fluorophenyl)2methyl4(4(morpholin4yl)phenyl)5oxo145678hexahydroquinoline3carboxylate
ethyl7(4fluorophenyl)2methyl4(4morpholin4ylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC29H31FN2O4c133629(34)2618(2)31241621(194822(30)9519)1725(33)28(24)27(26)2061023(11720)32121435151332h411212731H31217H212H3
MFCD04216082
ZINC000002844599
ZINC000020323384

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Available files

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