Vitas-M small molecule compound
3-({[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-[4-(2-methylpropoxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK465594
SMILES C=CCn1c(nnc1c1ccc(cc1)OCC(C)C)SCc1csc(n1)c1ccccc1Cl
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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 C25H25ClN4OS2 MW 497.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4OS2/c1-4-13-30-23(18-9-11-20(12-10-18)31-14-17(2)3)28-29-25(30)33-16-19-15-32-24(27-19)21-7-5-6-8-22(21)26/h4-12,15,17H,1,13-14,16H2,2-3H3InChIKey
CDVLLMCQDSRLNA-UHFFFAOYSA-NSynonyms
1(5((2(2CHLOROPHENYL)(13THIAZOL4YL))METHYLTHIO)4PROP2ENYL(124TRIAZOL3YL))4(2METHYLPROPOXY)BENZENE
2(2chlorophenyl)4((5(4(2methylpropoxy)phenyl)4prop2enyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(2chlorophenyl)13thiazol4yl)methyl)sulfanyl)5(4(2methylpropoxy)phenyl)4(prop2en1yl)4H124triazole
CC(C)COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CSC(=N3)C4=CC=CC=C4Cl
InChI=1SC25H25ClN4OS2c14133023(1891120(121018)311417(2)3)282925(30)331619153224(2719)21756822(21)26h4121517H1131416H223H3
MFCD06189269
ZINC000020468733
ZINC20468733
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