Vitas-M small molecule compound

2-(diethylamino)ethyl 4-({3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoate

Catalog ID
STK538591
SMILES CCN(CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)CC

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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 C26H28ClN3O4S2 MW 546.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClN3O4S2/c1-3-29(4-2)15-16-34-25(33)18-9-11-20(12-10-18)28-23(31)13-14-30-24(32)22(36-26(30)35)17-19-7-5-6-8-21(19)27/h5-12,17H,3-4,13-16H2,1-2H3,(H,28,31)/b22-17-
InChIKey
OWRVECPGFNPHIR-XLNRJJMWSA-N
Synonyms
369398-85-6
(Z)2(diethylamino)ethyl4(3(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)propanamido)benzoate
2(diethylamino)ethyl4((3((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)benzoate
2(diethylamino)ethyl4(3((5Z)5((2chlorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoylamino)benzoate
2DIETHYLAMINOETHYL4(3((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOATE
369398856
CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC3=CC=CC=C3Cl)SC2=S
CCN(CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)SC(=Cc2ccccc2Cl)C1=O)CC
InChI=1SC26H28ClN3O4S2c1329(42)15163425(33)1891120(121018)2823(31)13143024(32)22(3626(30)35)1719756821(19)27h51217H341316H212H3(H2831)b2217
MFCD02369633
ZINC000100805467
ZINC100805467

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Available files

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