Vitas-M small molecule compound
6-(azepan-1-yl)-1,4-dimethyl-5-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STK597981
SMILES N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCC(C)C)c(n(c1=O)C)N1CCCCCC1
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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 C23H30N4O2S2 MW 458.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S2/c1-15(2)9-12-27-22(29)19(31-23(27)30)13-17-16(3)18(14-24)21(28)25(4)20(17)26-10-7-5-6-8-11-26/h13,15H,5-12H2,1-4H3/b19-13-InChIKey
CGSRNHDAIILKDO-UYRXBGFRSA-NSynonyms
619268-53-0(Z)6(azepan1yl)5((3isopentyl4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl2oxo12dihydropyridine3carbonitrile
6(AZEPAN1YL)14DIMETHYL5((Z)(3(3METHYLBUTYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2OXOPYRIDINE3CARBONITRILE
6(azepan1yl)14dimethyl5((Z)(3(3methylbutyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2oxo12dihydropyridine3carbonitrile
619268530
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC(C)C)N3CCCCCC3)C)C#N
InChI=1SC23H30N4O2S2c115(2)9122722(29)19(3123(27)30)131716(3)18(1424)21(28)25(4)20(17)261075681126h1315H512H214H3b1913
MFCD03694354
N#Cc1c(C)c(C=C2SC(=S)N(C2=O)CCC(C)C)c(n(c1=O)C)N1CCCCCC1
ZINC000002416144
ZINC02416144
ZINC2416144
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