Vitas-M small molecule compound
2-{[5-(4-aminophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-bromo-2-fluorophenyl)acetamide
Catalog ID
STK232933
SMILES O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1c1ccccc1)c1ccc(cc1)N
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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 C22H17BrFN5OS MW 498.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrFN5OS/c23-15-8-11-19(18(24)12-15)26-20(30)13-31-22-28-27-21(14-6-9-16(25)10-7-14)29(22)17-4-2-1-3-5-17/h1-12H,13,25H2,(H,26,30)InChIKey
PECKWRRFNZRGJM-UHFFFAOYSA-NSynonyms
2((5(4AMINOPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(4BROMO2FLUOROPHENYL)ACETAMIDE
2((5(4AMINOPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N(4BROMO2FLUOROPHENYL)ACETAMIDE
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)Br)F)C4=CC=C(C=C4)N
InChI=1SC22H17BrFN5OSc231581119(18(24)1215)2620(30)133122282721(146916(25)10714)29(22)174213517h112H1325H2(H2630)
MFCD04401248
ZINC000009290986
ZINC09290986
ZINC9290986
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