Vitas-M small molecule compound

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

Catalog ID
STK797252
SMILES CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N(C2CCCCC2)C)/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 C23H28N4O2S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O2S2/c1-3-4-13-27-22(29)18(31-23(27)30)15-17-20(25(2)16-10-6-5-7-11-16)24-19-12-8-9-14-26(19)21(17)28/h8-9,12,14-16H,3-7,10-11,13H2,1-2H3/b18-15-
InChIKey
XLRRDYVETGLAAN-SDXDJHTJSA-N
Synonyms

(5Z)3BUTYL5((2(CYCLOHEXYL(METHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(cyclohexyl(methyl)amino)4Hpyrido(12a)pyrimidin4one
CCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N(C)C4CCCCC4)SC1=S
CCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N(C2CCCCC2)C)C1=O
InChI=1SC23H28N4O2S2c134132722(29)18(3123(27)30)151720(25(2)16106571116)241912891426(19)21(17)28h89121416H37101113H212H3b1815
MFCD03225916
ZINC000016699785
ZINC16699785

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Available files

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