Vitas-M small molecule compound
ethyl 4-{3-chloro-4-[(2-cyanobenzyl)oxy]-5-methoxyphenyl}-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate
Catalog ID
STL374363
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cc(Cl)c(c(c1)OC)OCc1ccccc1C#N)C(=O)c1c2cccc1
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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 C31H25ClN2O5 MW 541.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN2O5/c1-4-38-31(36)25-17(2)34-28-21-11-7-8-12-22(21)29(35)27(28)26(25)20-13-23(32)30(24(14-20)37-3)39-16-19-10-6-5-9-18(19)15-33/h5-14,26,34H,4,16H2,1-3H3InChIKey
PRLITMUWKQNSDC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)Cl)OCC4=CC=CC=C4C#N)OC)C(=O)C5=CC=CC=C52)C
ethyl4(3chloro4((2cyanobenzyl)oxy)5methoxyphenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
ETHYL4(3CHLORO4((2CYANOPHENYL)METHOXY)5METHOXYPHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
InChI=1SC31H25ClN2O5c143831(36)2517(2)34282111781222(21)29(35)27(28)26(25)201323(32)30(24(1420)373)3916191065918(19)1533h5142634H416H213H3
MFCD03031775
ZINC000100231978
ZINC000100231980
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