Vitas-M small molecule compound

2-methoxyethyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK004559
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)Cl)C(=O)CC(C2)c1cccc(c1)OC

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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 C30H28ClNO7 MW 550.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClNO7/c1-16-26(30(35)38-10-9-36-2)27(22-15-39-25-8-7-19(31)14-21(25)29(22)34)28-23(32-16)12-18(13-24(28)33)17-5-4-6-20(11-17)37-3/h4-8,11,14-15,18,27,32H,9-10,12-13H2,1-3H3
InChIKey
ZDFHIEBRZVTDSO-UHFFFAOYSA-N
Synonyms

2methoxyethyl4(6chloro4oxo4Hchromen3yl)7(3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(6chloro4oxochromen3yl)7(3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=CC=C3)OC)C4=COC5=C(C4=O)C=C(C=C5)Cl)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)Cl)C(=O)CC(C2)c1cccc(c1)OC
InChI=1SC30H28ClNO7c11626(30(35)38109362)27(221539258719(31)1421(25)29(22)34)2823(3216)1218(1324(28)33)1754620(1117)373h48111415182732H9101213H213H3
MFCD03489314
STK004559
ZINC000002758768
ZINC000002758771

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Available files

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