Vitas-M small molecule compound
ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperazine-1-carboxylate
Catalog ID
STK837413
SMILES CCOC(=O)N1CCN(CC1)C(=O)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/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 C21H24ClN3O4S2 MW 482.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4S2/c1-2-29-20(28)24-12-10-23(11-13-24)18(26)8-5-9-25-19(27)17(31-21(25)30)14-15-6-3-4-7-16(15)22/h3-4,6-7,14H,2,5,8-13H2,1H3/b17-14-InChIKey
FOUGYKYLEBSCJK-VKAVYKQESA-NSynonyms
(Z)ethyl4(4(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)butanoyl)piperazine1carboxylate
CCOC(=O)N1CCN(CC1)C(=O)CCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
CCOC(=O)N1CCN(CC1)C(=O)CCCN2C(=O)C(=CC3=CC=CC=C3Cl)SC2=S
ETHYL4(4((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOYL)PIPERAZINE1CARBOXYLATE
ethyl4(4((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)butanoyl)piperazine1carboxylate
InChI=1SC21H24ClN3O4S2c122920(28)24121023(111324)18(26)8592519(27)17(3121(25)30)1415634716(15)22h346714H25813H21H3b1714
MFCD02985260
ZINC000009065834
ZINC09065834
ZINC9065834
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