Vitas-M small molecule compound
3-[(4-bromobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STL347813
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)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 C22H17BrClN3OS MW 486.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrClN3OS/c1-28-20-12-4-16(5-13-20)21-25-26-22(27(21)19-10-8-18(24)9-11-19)29-14-15-2-6-17(23)7-3-15/h2-13H,14H2,1H3InChIKey
DFUIMKBIXRNTKE-UHFFFAOYSA-NSynonyms
861148-25-63((4bromobenzyl)sulfanyl)4(4chlorophenyl)5(4methoxyphenyl)4H124triazole
3((4bromobenzyl)thio)4(4chlorophenyl)5(4methoxyphenyl)4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOLE
861148256
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Br
InChI=1SC22H17BrClN3OSc1282012416(51320)21252622(27(21)1910818(24)91119)2914152617(23)7315h213H14H21H3
MFCD03473638
ZINC000009308259
ZINC09308259
ZINC9308259
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