Vitas-M small molecule compound

2-ethyl-6-[(4-fluorophenyl)carbonyl]-5,11-dihydro-4H-thieno[3',2':5,6]pyrimido[1,2-b]isoquinolin-4-one

Catalog ID
STK529078
SMILES CCc1cc2c(s1)n1Cc3ccccc3C(=c1[nH]c2=O)C(=O)c1ccc(cc1)F

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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 C23H17FN2O2S MW 404.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FN2O2S/c1-2-16-11-18-22(28)25-21-19(20(27)13-7-9-15(24)10-8-13)17-6-4-3-5-14(17)12-26(21)23(18)29-16/h3-11H,2,12H2,1H3,(H,25,28)
InChIKey
BGDWOKLMDLYXBR-UHFFFAOYSA-N
Synonyms

2ethyl6((4fluorophenyl)carbonyl)511dihydro4Hthieno(3256)pyrimido(12b)isoquinolin4one
2ETHYL6(4FLUOROBENZOYL)511DIHYDRO1THIA511ADIAZACYCLOPENTA(A)ANTHRACEN4ONE
2ethyl6(4fluorobenzoyl)511dihydro4Hthieno(3256)pyrimido(12b)isoquinolin4one
CCC1=CC2=C(S1)N3CC4=CC=CC=C4C(=C3NC2=O)C(=O)C5=CC=C(C=C5)F
CCc1cc2c(s1)n1Cc3ccccc3C(=c1(nH)c2=O)C(=O)c1ccc(cc1)F
InChI=1SC23H17FN2O2Sc1216111822(28)252119(20(27)137915(24)10813)17643514(17)1226(21)23(18)2916h311H212H21H3(H2528)
MFCD00572213
ZINC000002361980
ZINC02361980
ZINC2361980

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Available files

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