Vitas-M small molecule compound

3-(butan-2-yl)-11-[3-(trifluoromethyl)phenyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK637141
SMILES CCC(n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C(F)(F)F)C

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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 C23H18F3N5O MW 437.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18F3N5O/c1-3-13(2)30-12-27-20-18(22(30)32)19-21(29-17-10-5-4-9-16(17)28-19)31(20)15-8-6-7-14(11-15)23(24,25)26/h4-13H,3H2,1-2H3
InChIKey
XQSWYOOYQBYHLH-UHFFFAOYSA-N
Synonyms
843632-90-6
3(butan2yl)11(3(trifluoromethyl)phenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11(3(trifluoromethyl)phenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
843632906
CCC(C)N1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=CC(=C5)C(F)(F)F
InChI=1SC23H18F3N5Oc1313(2)3012272018(22(30)32)1921(29171054916(17)2819)31(20)1586714(1115)23(2425)26h413H3H212H3
MFCD04154606
ZINC000002399932
ZINC000002399933

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Available files

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