Vitas-M small molecule compound
methyl 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
STK880562
SMILES CCCCN1C(=S)S/C(=C/2\C(=O)N(c3c2cccc3)CC(=O)Nc2ccc(cc2)C(=O)OC)/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 C25H23N3O5S2 MW 509.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S2/c1-3-4-13-27-23(31)21(35-25(27)34)20-17-7-5-6-8-18(17)28(22(20)30)14-19(29)26-16-11-9-15(10-12-16)24(32)33-2/h5-12H,3-4,13-14H2,1-2H3,(H,26,29)/b21-20-InChIKey
GWZFSKMDFZWGDI-MRCUWXFGSA-NSynonyms
609796-91-0609796910
CCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OC)SC1=S
CCCCN1C(=S)SC(=C2C(=O)N(c3c2cccc3)CC(=O)Nc2ccc(cc2)C(=O)OC)C1=O
InChI=1SC25H23N3O5S2c134132723(31)21(3525(27)34)2017756818(17)28(22(20)30)1419(29)261611915(101216)24(32)332h512H341314H212H3(H2629)b2120
methyl4((((3Z)3(3butyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetyl)amino)benzoate
METHYL4((2((3Z)3(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETYL)AMINO)BENZOATE
METHYL4(2(3(3BUTYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)ACETAMIDO)BENZOATE
MFCD04441209
ZINC000016729577
ZINC16729577
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.