Vitas-M small molecule compound

2-(4-ethylphenyl)-2-oxoethyl 3-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate

Catalog ID
STK327479
SMILES CCc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)c(C)nc1c2cccc1

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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 C29H22N2O5 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O5/c1-3-18-11-13-19(14-12-18)24(32)16-36-29(35)20-7-6-8-21(15-20)31-27(33)25-17(2)30-23-10-5-4-9-22(23)26(25)28(31)34/h4-15H,3,16H2,1-2H3
InChIKey
KTIPVKUYIZLDGR-UHFFFAOYSA-N
Synonyms
524043-34-3
(2(4ETHYLPHENYL)2OXIDANYLIDENEETHYL)3(4METHYL13BIS(OXIDANYLIDENE)PYRROLO(34C)QUINOLIN2YL)BENZOATE
(2(4ETHYLPHENYL)2OXOETHYL)3(4METHYL13DIOXOPYRROLO(34C)QUINOLIN2YL)BENZOATE
2(4ethylphenyl)2oxoethyl3(4methyl13dioxo13dihydro2Hpyrrolo(34c)quinolin2yl)benzoate
2(4ethylphenyl)2oxoethyl3(4methyl13dioxo1Hpyrrolo(34c)quinolin2(3H)yl)benzoate
3(13DIKETO4METHYLPYRROLO(34C)QUINOLIN2YL)BENZOICACID(2(4ETHYLPHENYL)2KETOETHYL)ESTER
3(4METHYL13DIOXO2PYRROLO(34C)QUINOLINYL)BENZOICACID(2(4ETHYLPHENYL)2OXOETHYL)ESTER
524043343
CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C5=CC=CC=C5N=C4C
InChI=1SC29H22N2O5c1318111319(141218)24(32)163629(35)2076821(1520)3127(33)2517(2)30231054922(23)26(25)28(31)34h415H316H212H3
MFCD03615087
ZINC000001164975
ZINC01164975
ZINC1164975

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Available files

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