Vitas-M small molecule compound
3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(3-chlorophenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK798934
SMILES CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2cccc(c2)Cl)/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 C27H28ClN5O2S2 MW 554.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClN5O2S2/c1-3-4-10-33-26(35)22(37-27(33)36)17-21-24(29-23-18(2)7-6-11-32(23)25(21)34)31-14-12-30(13-15-31)20-9-5-8-19(28)16-20/h5-9,11,16-17H,3-4,10,12-15H2,1-2H3/b22-17-InChIKey
AHHZEWNVNSJJKK-XLNRJJMWSA-NSynonyms
(5Z)3BUTYL5((2(4(3CHLOROPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3butyl5((2(4(3chlorophenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(3chlorophenyl)piperazin1yl)9methyl4Hpyrido(12a)pyrimidin4one
CCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCN(CC4)C5=CC(=CC=C5)Cl)SC1=S
CCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2cccc(c2)Cl)C1=O
InChI=1SC27H28ClN5O2S2c134103326(35)22(3727(33)36)172124(292318(2)761132(23)25(21)34)31141230(131531)2095819(28)1620h59111617H34101215H212H3b2217
MFCD03008172
ZINC000097946209
ZINC97946209
Check stock
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Check stock on Vitas-MAvailable files
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