Vitas-M small molecule compound
5-({4-[(3,4-dimethylphenyl)sulfanyl]phenyl}sulfonyl)-2-(3-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STL571294
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)c2c1cc(cc2)S(=O)(=O)c1ccc(cc1)Sc1ccc(c(c1)C)C
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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 C28H20N2O6S2 MW 544.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N2O6S2/c1-17-6-7-22(14-18(17)2)37-21-8-10-23(11-9-21)38(35,36)24-12-13-25-26(16-24)28(32)29(27(25)31)19-4-3-5-20(15-19)30(33)34/h3-16H,1-2H3InChIKey
PXNTWRFGASOAGM-UHFFFAOYSA-NSynonyms
5((4((34dimethylphenyl)sulfanyl)phenyl)sulfonyl)2(3nitrophenyl)1Hisoindole13(2H)dione
5(4(34dimethylphenyl)sulfanylphenyl)sulfonyl2(3nitrophenyl)isoindole13dione
51345579
InChI=1SC28H20N2O6S2c1176722(1418(17)2)372181023(11921)38(3536)2412132526(1624)28(32)29(27(25)31)1943520(1519)30(33)34h316H12H3
MFCD02614399
ZINC000109768944
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