Vitas-M small molecule compound
2-methoxy-4-{(E)-[3-(4-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl benzoate
Catalog ID
STL427572
SMILES COc1cc(ccc1OC(=O)c1ccccc1)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)OC
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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 C25H19NO5S2 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO5S2/c1-29-19-11-9-18(10-12-19)26-23(27)22(33-25(26)32)15-16-8-13-20(21(14-16)30-2)31-24(28)17-6-4-3-5-7-17/h3-15H,1-2H3/b22-15+InChIKey
QLVHOHYXBMVVND-PXLXIMEGSA-NSynonyms
(2METHOXY4((E)(3(4METHOXYPHENYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)BENZOATE
2methoxy4((E)(3(4methoxyphenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenylbenzoate
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC)SC2=S
COc1cc(ccc1OC(=O)c1ccccc1)C=C1SC(=S)N(C1=O)c1ccc(cc1)OC
InChI=1SC25H19NO5S2c1291911918(101219)2623(27)22(3325(26)32)151681320(21(1416)302)3124(28)176435717h315H12H3b2215+
MFCD01335253
ZINC000009296600
ZINC09296600
ZINC9296600
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