Vitas-M small molecule compound
4,4'-(pyridin-3-ylmethanediyl)bis{1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-1H-pyrazol-5-ol}
Catalog ID
STK015263
SMILES Cc1ccc(cc1)c1csc(n1)n1nc(c(c1O)C(c1c(nn(c1O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)[N+](=O)[O-])c1cccnc1)c1ccc(cc1)[N+](=O)[O-]
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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 C44H31N9O6S2 MW 845.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H31N9O6S2/c1-25-5-9-27(10-6-25)34-23-60-43(46-34)50-41(54)37(39(48-50)29-13-17-32(18-14-29)52(56)57)36(31-4-3-21-45-22-31)38-40(30-15-19-33(20-16-30)53(58)59)49-51(42(38)55)44-47-35(24-61-44)28-11-7-26(2)8-12-28/h3-24,36,54-55H,1-2H3InChIKey
PLIJSJDIILWYJN-UHFFFAOYSA-NSynonyms
44(pyridin3ylmethanediyl)bis(1(4(4methylphenyl)13thiazol2yl)3(4nitrophenyl)1Hpyrazol5ol)
Cc1ccc(cc1)c1csc(n1)n1nc(c(c1O)C(c1c(nn(c1O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)(N+)(=O)(O))c1cccnc1)c1ccc(cc1)(N+)(=O)(O)
MFCD01630508
STK015263
ZINC000150340718
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