Vitas-M small molecule compound
5-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-6-(thiomorpholin-4-yl)-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL010273
SMILES N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)C2CCCC2)c(n(c1=O)C)N1CCSCC1
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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 C21H24N4O2S3 MW 460.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S3/c1-13-15(11-17-20(27)25(21(28)30-17)14-5-3-4-6-14)18(24-7-9-29-10-8-24)23(2)19(26)16(13)12-22/h11,14H,3-10H2,1-2H3/b17-11-InChIKey
XRYNDDQUJDBSEE-BOPFTXTBSA-NSynonyms
620152-00-3(Z)5((3cyclopentyl4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl2oxo6thiomorpholino12dihydropyridine3carbonitrile
5((Z)(3CYCLOPENTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL2OXO6THIOMORPHOLIN4YLPYRIDINE3CARBONITRILE
5((Z)(3cyclopentyl4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl2oxo6(thiomorpholin4yl)12dihydropyridine3carbonitrile
620152003
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)C3CCCC3)N4CCSCC4)C)C#N
InChI=1SC21H24N4O2S3c11315(111720(27)25(21(28)3017)14534614)18(24792910824)23(2)19(26)16(13)1222h1114H310H212H3b1711
MFCD03693552
N#Cc1c(C)c(C=C2SC(=S)N(C2=O)C2CCCC2)c(n(c1=O)C)N1CCSCC1
ZINC000002255898
ZINC02255898
ZINC2255898
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