Vitas-M small molecule compound

3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-tert-butylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK881362
SMILES CCCCN1C(=S)S/C(=C\c2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)/C1=O

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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 C26H27N3O3S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S2/c1-5-6-14-29-24(31)20(34-25(29)33)16-19-22(27-21-9-7-8-15-28(21)23(19)30)32-18-12-10-17(11-13-18)26(2,3)4/h7-13,15-16H,5-6,14H2,1-4H3/b20-16-
InChIKey
MSIURFKKWBNPTJ-SILNSSARSA-N
Synonyms
799776-77-5
(5Z)3BUTYL5((2(4TERTBUTYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3butyl5((2(4(tertbutyl)phenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4tertbutylphenoxy)4Hpyrido(12a)pyrimidin4one
799776775
CCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)C(C)(C)C)SC1=S
CCCCN1C(=S)SC(=Cc2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)C1=O
InChI=1SC26H27N3O3S2c156142924(31)20(3425(29)33)161922(27219781528(21)23(19)30)3218121017(111318)26(23)4h7131516H5614H214H3b2016
MFCD03672968
ZINC000002207587
ZINC2207587

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Available files

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