Vitas-M small molecule compound
1-[2-(2,4-dimethylphenyl)-4,5-bis(propylsulfonyl)furan-3-yl]-3,5-dimethylpyridinium
Catalog ID
STK524169
SMILES CCCS(=O)(=O)c1oc(c(c1S(=O)(=O)CCC)[n+]1cc(C)cc(c1)C)c1ccc(cc1C)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 C25H32NO5S2 MW 490.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32NO5S2/c1-7-11-32(27,28)24-22(26-15-18(4)13-19(5)16-26)23(21-10-9-17(3)14-20(21)6)31-25(24)33(29,30)12-8-2/h9-10,13-16H,7-8,11-12H2,1-6H3/q+1InChIKey
POOCBUGAKLBJHL-UHFFFAOYSA-NSynonyms
1(2(24DIMETHYLPHENYL)45BIS(PROPYLSULFONYL)3FURYL)35DIMETHYLPYRIDINIUM
1(2(24dimethylphenyl)45bis(propylsulfonyl)furan3yl)35dimethylpyridin1ium
1(2(24dimethylphenyl)45bis(propylsulfonyl)furan3yl)35dimethylpyridinium
CCCS(=O)(=O)C1=C(OC(=C1(N+)2=CC(=CC(=C2)C)C)C3=C(C=C(C=C3)C)C)S(=O)(=O)CCC
CCCS(=O)(=O)c1oc(c(c1S(=O)(=O)CCC)(n+)1cc(C)cc(c1)C)c1ccc(cc1C)C
InChI=1SC25H32NO5S2c171132(2728)2422(261518(4)1319(5)1626)23(2110917(3)1420(21)6)3125(24)33(2930)1282h9101316H781112H216H3q+1
ZINC000035324284
ZINC35324284
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