Vitas-M small molecule compound
N-(4-bromo-2,6-dimethylphenyl)-2-{[4-(3,4-dimethylphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK113140
SMILES O=C(Nc1c(C)cc(cc1C)Br)CSc1nnc(n1c1ccc(c(c1)C)C)C
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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 C21H23BrN4OS MW 459.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4OS/c1-12-6-7-18(10-13(12)2)26-16(5)24-25-21(26)28-11-19(27)23-20-14(3)8-17(22)9-15(20)4/h6-10H,11H2,1-5H3,(H,23,27)InChIKey
UNKOURXGVMPDRD-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3C)Br)C)C)C
InChI=1SC21H23BrN4OSc1126718(1013(12)2)2616(5)242521(26)281119(27)232014(3)817(22)915(20)4h610H11H215H3(H2327)
MFCD04127461
N(4BROMO26DIMETHYLPHENYL)2((4(34DIMETHYLPHENYL)5METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO26DIMETHYLPHENYL)2((4(34DIMETHYLPHENYL)5METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001104708
ZINC01104708
ZINC1104708
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