Vitas-M small molecule compound
4-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 2-nitrobenzenesulfonate
Catalog ID
STL365341
SMILES COc1cc(ccc1OS(=O)(=O)c1ccccc1[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 C24H18N2O7S3 MW 542.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O7S3/c1-32-20-13-17(14-21-23(27)25(24(34)35-21)15-16-7-3-2-4-8-16)11-12-19(20)33-36(30,31)22-10-6-5-9-18(22)26(28)29/h2-14H,15H2,1H3/b21-14+InChIKey
XTTLSZFVSLTGFN-KGENOOAVSA-NSynonyms
(4((E)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenyl)2nitrobenzenesulfonate
2METHOXY4((4OXO3BENZYL2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)PHENYL2NITROBENZENESULFONATE
4((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl2nitrobenzenesulfonate
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4(N+)(=O)(O)
COc1cc(ccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC24H18N2O7S3c132201317(142123(27)25(24(34)3521)15167324816)111219(20)3336(3031)221065918(22)26(28)29h214H15H21H3b2114+
MFCD02122444
ZINC000100314936
ZINC100314936
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