Vitas-M small molecule compound
5-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL005233
SMILES CCCCCCN1C(=S)S/C(=C\c2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)/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 C23H31N5O2S2 MW 473.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N5O2S2/c1-5-6-7-8-9-28-22(30)19(32-23(28)31)14-17-16(2)18(15-24)21(29)26(4)20(17)27-12-10-25(3)11-13-27/h14H,5-13H2,1-4H3/b19-14-InChIKey
ZESAXJSJHITIRM-RGEXLXHISA-NSynonyms
620149-23-7(Z)5((3hexyl4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl6(4methylpiperazin1yl)2oxo12dihydropyridine3carbonitrile
5((Z)(3HEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL6(4METHYLPIPERAZIN1YL)2OXOPYRIDINE3CARBONITRILE
5((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl6(4methylpiperazin1yl)2oxo12dihydropyridine3carbonitrile
620149237
CCCCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)C)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)C1=O
InChI=1SC23H31N5O2S2c1567892822(30)19(3223(28)31)141716(2)18(1524)21(29)26(4)20(17)27121025(3)111327h14H513H214H3b1914
MFCD03692818
ZINC000002254435
ZINC2254435
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