Vitas-M small molecule compound
3-(4-tert-butylphenyl)-5-[(2,4-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STK064314
SMILES COc1ccc(cc1)n1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1Cl)Cl
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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 C26H25Cl2N3OS MW 498.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25Cl2N3OS/c1-26(2,3)19-8-5-17(6-9-19)24-29-30-25(31(24)21-11-13-22(32-4)14-12-21)33-16-18-7-10-20(27)15-23(18)28/h5-15H,16H2,1-4H3InChIKey
XMKHWOMHQFFSLT-UHFFFAOYSA-NSynonyms
499103-50-31(3((24DICHLOROPHENYL)METHYLTHIO)5(4(TERTBUTYL)PHENYL)(124TRIAZOL4YL))4METHOXYBENZENE
3(4(tertbutyl)phenyl)5((24dichlorobenzyl)thio)4(4methoxyphenyl)4H124triazole
3(4TERTBUTYLPHENYL)5(((24DICHLOROPHENYL)METHYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
3(4TERTBUTYLPHENYL)5((24DICHLOROBENZYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
3(4TERTBUTYLPHENYL)5((24DICHLOROPHENYL)METHYLSULFANYL)4(4METHOXYPHENYL)124TRIAZOLE
499103503
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC4=C(C=C(C=C4)Cl)Cl
COc1ccc(cc1)n1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1Cl)Cl
InChI=1SC26H25Cl2N3OSc126(23)198517(6919)24293025(31(24)21111322(324)141221)33161871020(27)1523(18)28h515H16H214H3
MFCD03474131
STK064314
ZINC000001895944
ZINC01895944
ZINC1895944
Check stock
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Check stock on Vitas-MAvailable files
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