Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK817821
SMILES CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)/C1=O)C
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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 C28H31N5O2S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S2/c1-4-20(3)33-27(35)23(37-28(33)36)16-22-25(29-24-11-10-19(2)17-32(24)26(22)34)31-14-12-30(13-15-31)18-21-8-6-5-7-9-21/h5-11,16-17,20H,4,12-15,18H2,1-3H3/b23-16-InChIKey
PKINDBXGYDXYSB-KQWNVCNZSA-NSynonyms
615275-67-7(5Z)5((2(4BENZYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3BUTAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(secbutyl)2thioxothiazolidin4one
2(4benzylpiperazin1yl)3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
615275677
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)CC5=CC=CC=C5)SC1=S
CCC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)C1=O)C
InChI=1SC28H31N5O2S2c1420(3)3327(35)23(3728(33)36)162225(2924111019(2)1732(24)26(22)34)31141230(131531)18218657921h511161720H4121518H213H3b2316
MFCD03664287
ZINC000100763625
ZINC000100763633
Check stock
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Check stock on Vitas-MAvailable files
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