Vitas-M small molecule compound
4-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl (3s,5s,7s)-tricyclo[3.3.1.1~3,7~]decane-1-carboxylate
Catalog ID
STL428795
SMILES COc1cc(ccc1OC(=O)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C29H29NO4S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO4S2/c1-33-24-12-19(13-25-26(31)30(28(35)36-25)17-18-5-3-2-4-6-18)7-8-23(24)34-27(32)29-14-20-9-21(15-29)11-22(10-20)16-29/h2-8,12-13,20-22H,9-11,14-17H2,1H3/b25-13+/t20-,21+,22-,29?InChIKey
IBIVAOLUZLDGDR-USCWUJCTSA-NSynonyms
4((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl(3s5s7s)tricyclo(3311~37~)decane1carboxylate
COc1cc(ccc1OC(=O)C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)C=C1SC(=S)N(C1=O)Cc1ccccc1
ZINC000015011872
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