Vitas-M small molecule compound

11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK920293
SMILES COc1ccc(cc1)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CC1CCCO1

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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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c1-17-28-25-23(27(33)32(17)16-20-6-5-15-35-20)24-26(30-22-8-4-3-7-21(22)29-24)31(25)14-13-18-9-11-19(34-2)12-10-18/h3-4,7-12,20H,5-6,13-16H2,1-2H3
InChIKey
WNINNPZLNQNTOG-UHFFFAOYSA-N
Synonyms
836644-74-7
11(2(4methoxyphenyl)ethyl)2methyl3(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4methoxyphenethyl)2methyl3((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836644747
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC)C(=O)N1CC6CCCO6
InChI=1SC27H27N5O3c117282523(27(33)32(17)162065153520)2426(3022843721(22)2924)31(25)14131891119(342)121018h3471220H561316H212H3
MFCD03691349
ZINC000002253054
ZINC000002253055

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Available files

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