Vitas-M small molecule compound
3-(4-tert-butylphenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STK074194
SMILES COc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nnc1c1ccc(cc1)C(C)(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 C26H25Cl2N3OS MW 498.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25Cl2N3OS/c1-26(2,3)18-10-8-17(9-11-18)24-29-30-25(31(24)19-12-14-20(32-4)15-13-19)33-16-21-22(27)6-5-7-23(21)28/h5-15H,16H2,1-4H3InChIKey
KARBXKJUNDFUSR-UHFFFAOYSA-NSynonyms
499103-29-61(3((26DICHLOROPHENYL)METHYLTHIO)5(4(TERTBUTYL)PHENYL)(124TRIAZOL4YL))4METHOXYBENZENE
3(4(tertbutyl)phenyl)5((26dichlorobenzyl)thio)4(4methoxyphenyl)4H124triazole
3(4TERTBUTYLPHENYL)5((26DICHLOROBENZYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
3(4TERTBUTYLPHENYL)5((26DICHLOROPHENYL)METHYLSULFANYL)4(4METHOXYPHENYL)124TRIAZOLE
499103296
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC4=C(C=CC=C4Cl)Cl
COc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC26H25Cl2N3OSc126(23)1810817(91118)24293025(31(24)19121420(324)151319)33162122(27)65723(21)28h515H16H214H3
MFCD03474086
STK074194
ZINC000009008945
ZINC09008945
ZINC9008945
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