Vitas-M small molecule compound

8-fluoro-3-{[(E)-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

Catalog ID
STL251976
SMILES COc1ccc(cc1CSc1ccccn1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(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 C24H18FN5O2S MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18FN5O2S/c1-32-20-8-5-15(10-16(20)13-33-21-4-2-3-9-26-21)12-28-30-14-27-22-18-11-17(25)6-7-19(18)29-23(22)24(30)31/h2-12,14,29H,13H2,1H3/b28-12+
InChIKey
NOWRCMOWLQYZOJ-KVSWJAHQSA-N
Synonyms
848728-85-8
(E)8fluoro3((4methoxy3((pyridin2ylthio)methyl)benzylidene)amino)3Hpyrimido(54b)indol4(5H)one
8fluoro3(((E)(4methoxy3((pyridin2ylsulfanyl)methyl)phenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
8FLUORO3((1(4METHOXY3(PYRIDIN2YLSULFANYLMETHYL)PHENYL)METH(E)YLIDENE)AMINO)35DIHYDROPYRIMIDO(54B)INDOL4ONE
8FLUORO3((E)(4METHOXY3(PYRIDIN2YLSULFANYLMETHYL)PHENYL)METHYLIDENEAMINO)5HPYRIMIDO(54B)INDOL4ONE
COC1=C(C=C(C=C1)C=NN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F)CSC5=CC=CC=N5
COc1ccc(cc1CSc1ccccn1)C=Nn1cnc2c(c1=O)(nH)c1c2cc(cc1)F
Registry IDs
MFCD04193719
ZINC000013639064
ZINC2428995

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Available files

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