Vitas-M small molecule compound
1-(4-bromophenyl)-2-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Catalog ID
STK118861
SMILES CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1c1ccccc1
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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/c1-2-22-17(14-6-4-3-5-7-14)20-21-18(22)24-12-16(23)13-8-10-15(19)11-9-13/h3-11H,2,12H2,1H3InChIKey
KZUXOIAFDPJGCJ-UHFFFAOYSA-NSynonyms
1(4BROMOPHENYL)2((4ETHYL5PHENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4BROMOPHENYL)2((4ETHYL5PHENYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3
InChI=1SC18H16BrN3OSc122217(146435714)202118(22)241216(23)1381015(19)11913h311H212H21H3
MFCD04128089
ZINC000002841391
ZINC02841391
ZINC2841391
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