Vitas-M small molecule compound
3-[(4-bromobenzyl)sulfanyl]-5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazole
Catalog ID
STL294079
SMILES CCn1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1)Br
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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 C21H24BrN3S MW 430.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24BrN3S/c1-5-25-19(16-8-10-17(11-9-16)21(2,3)4)23-24-20(25)26-14-15-6-12-18(22)13-7-15/h6-13H,5,14H2,1-4H3InChIKey
CJWXHOGEJVVBBI-UHFFFAOYSA-NSynonyms
862186-01-43((4bromobenzyl)sulfanyl)5(4tertbutylphenyl)4ethyl4H124triazole
3((4bromobenzyl)thio)5(4(tertbutyl)phenyl)4ethyl4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOLE
862186014
CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC21H24BrN3Sc152519(1681017(11916)21(23)4)232420(25)26141561218(22)13715h613H514H214H3
MFCD05687992
ZINC000009027636
ZINC09027636
ZINC9027636
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