Vitas-M small molecule compound
(3s,5s,7s)-N-[(5E)-5-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK138153
SMILES COc1cc(ccc1OCc1ccccc1F)/C=C\1/SC(=S)N(C1=O)NC(=O)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3
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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 C29H29FN2O4S2 MW 552.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29FN2O4S2/c1-35-24-11-17(6-7-23(24)36-16-21-4-2-3-5-22(21)30)12-25-26(33)32(28(37)38-25)31-27(34)29-13-18-8-19(14-29)10-20(9-18)15-29/h2-7,11-12,18-20H,8-10,13-16H2,1H3,(H,31,34)/b25-12+/t18-,19+,20-,29?InChIKey
IWRXHXPLGZECTI-SJRZZSPBSA-NSynonyms
(3s5s7s)N((5E)5(4((2fluorobenzyl)oxy)3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)tricyclo(3311~37~)decane1carboxamide
COc1cc(ccc1OCc1ccccc1F)C=C1SC(=S)N(C1=O)NC(=O)C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3
MFCD08671372
ZINC000097959835
Check stock
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Check stock on Vitas-MAvailable files
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