Vitas-M small molecule compound
1-(dicyanomethylidene)-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 3,4,5-trimethoxybenzoate
Catalog ID
STK166941
SMILES N#CC(=C1c2cc(OC(=O)c3cc(OC)c(c(c3)OC)OC)cc3c2N(C1=O)C(C)(C)C=C3C)C#N
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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 C27H23N3O6 MW 485.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O6/c1-14-11-27(2,3)30-23-18(14)9-17(10-19(23)22(25(30)31)16(12-28)13-29)36-26(32)15-7-20(33-4)24(35-6)21(8-15)34-5/h7-11H,1-6H3InChIKey
WLDAQLSEUPKBHO-UHFFFAOYSA-NSynonyms
689754-64-11(DICYANOMETHYLENE)446TRIMETHYL2OXO12DIHYDRO4HPYRROLO(321IJ)QUINOLIN8YL345TRIMETHOXYBENZOATE
1(dicyanomethylene)446trimethyl2oxo24dihydro1Hpyrrolo(321ij)quinolin8yl345trimethoxybenzoate
1(DICYANOMETHYLIDENE)446TRIMETHYL2OXO12DIHYDRO4HPYRROLO(321IJ)QUINOLIN8YL345TRIMETHOXYBENZOATE
689754641
CC1=CC(N2C3=C(C=C(C=C13)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=C(C#N)C#N)C2=O)(C)C
InChI=1SC27H23N3O6c1141127(23)302318(14)917(1019(23)22(25(30)31)16(1228)1329)3626(32)15720(334)24(356)21(815)345h711H16H3
MFCD03871986
ZINC000009307255
ZINC09307255
ZINC9307255
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