Vitas-M small molecule compound
butyl 4-[(5Z)-5-{4-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate
Catalog ID
STK009130
SMILES CCCCOC(=O)c1ccc(cc1)N1C(=S)S/C(=C\c2ccc(cc2)OCCOc2ccc(cc2)C(C)(C)C)/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 C33H35NO5S2 MW 589.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35NO5S2/c1-5-6-19-39-31(36)24-9-13-26(14-10-24)34-30(35)29(41-32(34)40)22-23-7-15-27(16-8-23)37-20-21-38-28-17-11-25(12-18-28)33(2,3)4/h7-18,22H,5-6,19-21H2,1-4H3/b29-22-InChIKey
ZOLLQHOUAWTAPP-IADYIPOJSA-NSynonyms
BUTYL4((5Z)5((4(2(4TERTBUTYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOATE
BUTYL4((5Z)5(4(2(4TERTBUTYLPHENOXY)ETHOXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCCOC4=CC=C(C=C4)C(C)(C)C)SC2=S
CCCCOC(=O)c1ccc(cc1)N1C(=S)SC(=Cc2ccc(cc2)OCCOc2ccc(cc2)C(C)(C)C)C1=O
InChI=1SC33H35NO5S2c156193931(36)2491326(141024)3430(35)29(4132(34)40)222371527(16823)3720213828171125(121828)33(23)4h71822H561921H214H3b2922
MFCD03032480
STK009130
ZINC000097957840
ZINC97957840
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