Vitas-M small molecule compound
6-(azepan-1-yl)-5-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STK569855
SMILES CCOCCCN1C(=S)S/C(=C\c2c(N3CCCCCC3)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 C23H30N4O3S2 MW 474.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O3S2/c1-4-30-13-9-12-27-22(29)19(32-23(27)31)14-17-16(2)18(15-24)21(28)25(3)20(17)26-10-7-5-6-8-11-26/h14H,4-13H2,1-3H3/b19-14-InChIKey
HSHWKEZRRPRHJW-RGEXLXHISA-NSynonyms
619268-56-3(Z)6(azepan1yl)5((3(3ethoxypropyl)4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl2oxo12dihydropyridine3carbonitrile
6(AZEPAN1YL)5((Z)(3(3ETHOXYPROPYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL2OXOPYRIDINE3CARBONITRILE
6(azepan1yl)5((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl2oxo12dihydropyridine3carbonitrile
619268563
CCOCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCCCCC3)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(N3CCCCCC3)n(C)c(=O)c(c2C)C#N)C1=O
InChI=1SC23H30N4O3S2c1430139122722(29)19(3223(27)31)141716(2)18(1524)21(28)25(3)20(17)261075681126h14H413H213H3b1914
MFCD03692428
ZINC000002238316
ZINC02238316
ZINC2238316
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