Vitas-M small molecule compound
1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Catalog ID
STL004727
SMILES CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC(CC2)C(=O)N)/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 C23H27N5O3S2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S2/c1-4-14(3)28-22(31)17(33-23(28)32)12-16-20(26-10-7-15(8-11-26)18(24)29)25-19-13(2)6-5-9-27(19)21(16)30/h5-6,9,12,14-15H,4,7-8,10-11H2,1-3H3,(H2,24,29)/b17-12-InChIKey
QWYFJJCLHNGGPZ-ATVHPVEESA-NSynonyms
607706-44-5(Z)1(3((3(secbutyl)4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((Z)(3BUTAN2YL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
1(9METHYL3((3(METHYLPROPYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
607706445
CCC(C)N1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC(CC4)C(=O)N)SC1=S
CCC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCC(CC2)C(=O)N)C1=O)C
InChI=1SC23H27N5O3S2c1414(3)2822(31)17(3323(28)32)121620(2610715(81126)18(24)29)251913(2)65927(19)21(16)30h569121415H4781011H213H3(H22429)b1712
MFCD03667268
ZINC000002194419
ZINC000002194421
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