Vitas-M small molecule compound

2-{[5-(4,5-dibromothiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide

Catalog ID
STK306529
SMILES CCn1c(SCC(=O)NCC(C)C)nnc1c1sc(c(c1)Br)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 C14H18Br2N4OS2 MW 482.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18Br2N4OS2/c1-4-20-13(10-5-9(15)12(16)23-10)18-19-14(20)22-7-11(21)17-6-8(2)3/h5,8H,4,6-7H2,1-3H3,(H,17,21)
InChIKey
CDXXBNNZYSSYAR-UHFFFAOYSA-N
Synonyms
828280-49-5
2((5(45DIBROMOTHIOPHEN2YL)4ETHYL124TRIAZOL3YL)SULFANYL)N(2METHYLPROPYL)ACETAMIDE
2((5(45dibromothiophen2yl)4ethyl4H124triazol3yl)sulfanyl)N(2methylpropyl)acetamide
828280495
CCN1C(=NN=C1SCC(=O)NCC(C)C)C2=CC(=C(S2)Br)Br
InChI=1SC14H18Br2N4OS2c142013(1059(15)12(16)2310)181914(20)22711(21)1768(2)3h58H467H213H3(H1721)
MFCD04056376
ZINC000002790982
ZINC02790982
ZINC2790982

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.