Vitas-M small molecule compound
5-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-6-(4-methylpiperidin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL241932
SMILES CCC(N1C(=S)S/C(=C\c2c(N3CCC(CC3)C)n(C)c(=O)c(c2C)C#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 C22H28N4O2S2 MW 444.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O2S2/c1-6-14(3)26-21(28)18(30-22(26)29)11-16-15(4)17(12-23)20(27)24(5)19(16)25-9-7-13(2)8-10-25/h11,13-14H,6-10H2,1-5H3/b18-11-InChIKey
HWEIJTONBOOPPV-WQRHYEAKSA-NSynonyms
620154-84-9(Z)5((3(secbutyl)4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl6(4methylpiperidin1yl)2oxo12dihydropyridine3carbonitrile
5((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl6(4methylpiperidin1yl)2oxo12dihydropyridine3carbonitrile
5((Z)(3BUTAN2YL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL6(4METHYLPIPERIDIN1YL)2OXOPYRIDINE3CARBONITRILE
620154849
CCC(C)N1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCC(CC3)C)SC1=S
CCC(N1C(=S)SC(=Cc2c(N3CCC(CC3)C)n(C)c(=O)c(c2C)C#N)C1=O)C
InChI=1SC22H28N4O2S2c1614(3)2621(28)18(3022(26)29)111615(4)17(1223)20(27)24(5)19(16)259713(2)81025h111314H610H215H3b1811
MFCD03688224
ZINC000009461518
ZINC000011614266
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