Vitas-M small molecule compound

dimethyl 2-amino-1,4-bis(4-fluorophenyl)-7-(4-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK683197
SMILES COC(=O)C1C(CC2=C(C1=O)C(c1ccc(cc1)F)C(=C(N2c1ccc(cc1)F)N)C(=O)OC)c1ccc(cc1)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 C32H28F2N2O6 MW 574.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28F2N2O6/c1-40-22-14-6-17(7-15-22)23-16-24-27(29(37)26(23)31(38)41-2)25(18-4-8-19(33)9-5-18)28(32(39)42-3)30(35)36(24)21-12-10-20(34)11-13-21/h4-15,23,25-26H,16,35H2,1-3H3
InChIKey
KOYOCTDGXGOTJS-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C2CC3=C(C(C(=C(N3C4=CC=C(C=C4)F)N)C(=O)OC)C5=CC=C(C=C5)F)C(=O)C2C(=O)OC
dimethyl2amino14bis(4fluorophenyl)7(4methoxyphenyl)5oxo145678hexahydroquinoline36dicarboxylate
dimethyl2amino14bis(4fluorophenyl)7(4methoxyphenyl)5oxo4678tetrahydroquinoline36dicarboxylate
InChI=1SC32H28F2N2O6c1402214617(71522)23162427(29(37)26(23)31(38)412)25(184819(33)9518)28(32(39)423)30(35)36(24)21121020(34)111321h415232526H1635H213H3
MFCD05257000
ZINC000100156078
ZINC000100156088

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Available files

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