Vitas-M small molecule compound
ethyl 4-({[(3Z)-3-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetyl}amino)benzoate
Catalog ID
STK813297
SMILES CCCCCCCN1C(=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 C29H31N3O5S2 MW 565.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O5S2/c1-3-5-6-7-10-17-31-27(35)25(39-29(31)38)24-21-11-8-9-12-22(21)32(26(24)34)18-23(33)30-20-15-13-19(14-16-20)28(36)37-4-2/h8-9,11-16H,3-7,10,17-18H2,1-2H3,(H,30,33)/b25-24-InChIKey
SKSKDZIZPSTUBH-IZHYLOQSSA-NSynonyms
617696-29-4617696294
CCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OCC)SC1=S
CCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OCC)C1=O
ethyl4((((3Z)3(3heptyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetyl)amino)benzoate
ETHYL4((2((3Z)3(3HEPTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETYL)AMINO)BENZOATE
ETHYL4(2(3(3HEPTYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)ACETAMIDO)BENZOATE
InChI=1SC29H31N3O5S2c1356710173127(35)25(3929(31)38)242111891222(21)32(26(24)34)1823(33)3020151319(141620)28(36)3742h891116H37101718H212H3(H3033)b2524
MFCD03535263
ZINC000100871301
ZINC100871301
Check stock
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Check stock on Vitas-MAvailable files
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