Vitas-M small molecule compound
(3s,5s,7s)-N-[(5E)-5-{5-bromo-2-[(4-nitrobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STL380791
SMILES O=C(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)NN1C(=S)S/C(=C/c2cc(Br)ccc2OCc2ccc(cc2)[N+](=O)[O-])/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 C28H26BrN3O5S2 MW 628.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26BrN3O5S2/c29-21-3-6-23(37-15-16-1-4-22(5-2-16)32(35)36)20(10-21)11-24-25(33)31(27(38)39-24)30-26(34)28-12-17-7-18(13-28)9-19(8-17)14-28/h1-6,10-11,17-19H,7-9,12-15H2,(H,30,34)/b24-11+/t17-,18+,19-,28?InChIKey
JQICRDMZQYSAOB-LOXVZCHFSA-NSynonyms
(3s5s7s)N((5E)5(5bromo2((4nitrobenzyl)oxy)benzylidene)4oxo2thioxo13thiazolidin3yl)tricyclo(3311~37~)decane1carboxamide
O=C(C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)NN1C(=S)SC(=Cc2cc(Br)ccc2OCc2ccc(cc2)(N+)(=O)(O))C1=O
ZINC000150389848
Check stock
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