Vitas-M small molecule compound
3-[(3-bromobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STL347982
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCc1cccc(c1)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/c1-28-20-11-5-16(6-12-20)21-25-26-22(27(21)19-9-7-18(24)8-10-19)29-14-15-3-2-4-17(23)13-15/h2-13H,14H2,1H3InChIKey
XTSQODGPQJWOLY-UHFFFAOYSA-NSynonyms
861634-81-33((3bromobenzyl)sulfanyl)4(4chlorophenyl)5(4methoxyphenyl)4H124triazole
3((3bromobenzyl)thio)4(4chlorophenyl)5(4methoxyphenyl)4H124triazole
3((3BROMOPHENYL)METHYLSULFANYL)4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOLE
861634813
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC(=CC=C4)Br
InChI=1SC22H17BrClN3OSc1282011516(61220)21252622(27(21)199718(24)81019)29141532417(23)1315h213H14H21H3
MFCD03473653
ZINC000009309030
ZINC09309030
ZINC9309030
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