Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(3,5-dimethylpiperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK816056
SMILES CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CC(C)CC(C2)C)/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 C23H28N4O2S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O2S2/c1-5-16(4)27-22(29)18(31-23(27)30)11-17-20(25-12-14(2)10-15(3)13-25)24-19-8-6-7-9-26(19)21(17)28/h6-9,11,14-16H,5,10,12-13H2,1-4H3/b18-11-InChIKey
IUANQIQBGWOFIL-WQRHYEAKSA-NSynonyms
(5Z)3BUTAN2YL5((2(35DIMETHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)3(secbutyl)5((2(35dimethylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(35dimethylpiperidin1yl)4Hpyrido(12a)pyrimidin4one
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CC(CC(C4)C)C)SC1=S
CCC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CC(C)CC(C2)C)C1=O)C
InChI=1SC23H28N4O2S2c1516(4)2722(29)18(3123(27)30)111720(251214(2)1015(3)1325)2419867926(19)21(17)28h69111416H5101213H214H3b1811
MFCD04445970
ZINC000026531795
ZINC000036538847
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