Vitas-M small molecule compound

ethyl 4-({[(3Z)-3-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetyl}amino)benzoate

Catalog ID
STK702194
SMILES CCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OCC)/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 C26H25N3O5S2 MW 523.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O5S2/c1-3-5-14-28-24(32)22(36-26(28)35)21-18-8-6-7-9-19(18)29(23(21)31)15-20(30)27-17-12-10-16(11-13-17)25(33)34-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,27,30)/b22-21-
InChIKey
YJWATTIYRQDTNN-DQRAZIAOSA-N
Synonyms

(Z)ethyl4(2(3(3butyl4oxo2thioxothiazolidin5ylidene)2oxoindolin1yl)acetamido)benzoate
CCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OCC)SC1=S
CCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OCC)C1=O
ethyl4((((3Z)3(3butyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetyl)amino)benzoate
ETHYL4((2((3Z)3(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETYL)AMINO)BENZOATE
InChI=1SC26H25N3O5S2c135142824(32)22(3626(28)35)2118867919(18)29(23(21)31)1520(30)2717121016(111317)25(33)3442h613H351415H212H3(H2730)b2221
MFCD02993713
ZINC000009354877
ZINC09354877
ZINC9354877

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Available files

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