Vitas-M small molecule compound
4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK821723
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-])/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 C25H18N2O6S2 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O6S2/c1-32-21-13-17(7-12-20(21)33-24(29)18-8-10-19(11-9-18)27(30)31)14-22-23(28)26(25(34)35-22)15-16-5-3-2-4-6-16/h2-14H,15H2,1H3/b22-14-InChIKey
GZPPDWJUMUWKHC-HMAPJEAMSA-NSynonyms
(4((Z)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenyl)4nitrobenzoate
4((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl4nitrobenzoate
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC25H18N2O6S2c132211317(71220(21)3324(29)1881019(11918)27(30)31)142223(28)26(25(34)3522)15165324616h214H15H21H3b2214
MFCD01458110
ZINC000026965772
ZINC26965772
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