Vitas-M small molecule compound
2-(3,5-dimethylpiperidin-1-yl)-9-methyl-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK703886
SMILES CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CC(C)CC(C2)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 C25H32N4O2S2 MW 484.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O2S2/c1-5-6-7-10-29-24(31)20(33-25(29)32)13-19-22(27-14-16(2)12-17(3)15-27)26-21-18(4)9-8-11-28(21)23(19)30/h8-9,11,13,16-17H,5-7,10,12,14-15H2,1-4H3/b20-13-InChIKey
JLFXVGSQELOSEU-MOSHPQCFSA-NSynonyms
(5Z)5((2(35DIMETHYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)5((2(35dimethylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3pentyl2thioxothiazolidin4one
2(35dimethylpiperidin1yl)9methyl3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CC(CC(C4)C)C)SC1=S
CCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CC(C)CC(C2)C)C1=O
InChI=1SC25H32N4O2S2c1567102924(31)20(3325(29)32)131922(271416(2)1217(3)1527)262118(4)981128(21)23(19)30h8911131617H5710121415H214H3b2013
MFCD04446052
ZINC000002371779
ZINC000026531982
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