Vitas-M small molecule compound
ethyl 4-{3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-5-cyano-1,4-dimethyl-6-oxo-1,6-dihydropyridin-2-yl}piperazine-1-carboxylate
Catalog ID
STL003411
SMILES CCCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)C(=O)OCC)C)/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 C23H29N5O4S2 MW 503.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O4S2/c1-5-7-8-28-21(30)18(34-23(28)33)13-16-15(3)17(14-24)20(29)25(4)19(16)26-9-11-27(12-10-26)22(31)32-6-2/h13H,5-12H2,1-4H3/b18-13-InChIKey
FSOPPOGYJSGDOO-AQTBWJFISA-NSynonyms
619268-88-1(Z)ethyl4(3((3butyl4oxo2thioxothiazolidin5ylidene)methyl)5cyano14dimethyl6oxo16dihydropyridin2yl)piperazine1carboxylate
619268881
CCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)C(=O)OCC)SC1=S
CCCCN1C(=S)SC(=Cc2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)C(=O)OCC)C)C1=O
ETHYL4(3((Z)(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)5CYANO14DIMETHYL6OXOPYRIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)5cyano14dimethyl6oxo16dihydropyridin2yl)piperazine1carboxylate
InChI=1SC23H29N5O4S2c15782821(30)18(3423(28)33)131615(3)17(1424)20(29)25(4)19(16)2691127(121026)22(31)3262h13H512H214H3b1813
MFCD03694617
ZINC000002257115
ZINC02257115
ZINC2257115
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.