Vitas-M small molecule compound
2-{[5-(2-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
Catalog ID
STK273615
SMILES Cc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccccc1Br
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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 C18H16BrN3OS MW 402.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3OS/c1-12-7-9-13(10-8-12)16(23)11-24-18-21-20-17(22(18)2)14-5-3-4-6-15(14)19/h3-10H,11H2,1-2H3InChIKey
JBQPADXCFAJCGV-UHFFFAOYSA-NSynonyms
2((5(2bromophenyl)4methyl124triazol3yl)sulfanyl)1(4methylphenyl)ethanone
2((5(2bromophenyl)4methyl4H124triazol3yl)sulfanyl)1(4methylphenyl)ethanone
CC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C)C3=CC=CC=C3Br
InChI=1SC18H16BrN3OSc1127913(10812)16(23)112418212017(22(18)2)14534615(14)19h310H11H212H3
MFCD02588238
ZINC000000976248
ZINC00976248
ZINC976248
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