Vitas-M small molecule compound
3-[(4-bromobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STK575349
SMILES COc1cccc(c1)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/c1-28-20-4-2-3-16(13-20)21-25-26-22(27(21)19-11-9-18(24)10-12-19)29-14-15-5-7-17(23)8-6-15/h2-13H,14H2,1H3InChIKey
QHSCWAJHPCCTHW-UHFFFAOYSA-NSynonyms
861138-48-91(5((4BROMOPHENYL)METHYLTHIO)4(4CHLOROPHENYL)(124TRIAZOL3YL))3METHOXYBENZENE
3(((4BROMOPHENYL)METHYL)SULFANYL)4(4CHLOROPHENYL)5(3METHOXYPHENYL)4H124TRIAZOLE
3((4bromobenzyl)sulfanyl)4(4chlorophenyl)5(3methoxyphenyl)4H124triazole
3((4bromobenzyl)thio)4(4chlorophenyl)5(3methoxyphenyl)4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)4(4CHLOROPHENYL)5(3METHOXYPHENYL)124TRIAZOLE
861138489
COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Br
InChI=1SC22H17BrClN3OSc1282042316(1320)21252622(27(21)1911918(24)101219)2914155717(23)8615h213H14H21H3
MFCD05683657
ZINC000009307886
ZINC09307886
ZINC9307886
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