Vitas-M small molecule compound

2-(3-bromophenoxy)-N-[(2E)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide

Catalog ID
STL036536
SMILES Brc1cccc(c1)OCC(=O)/N=c/1\[nH]nc(s1)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 C13H14BrN3O2S MW 356.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14BrN3O2S/c1-8(2)12-16-17-13(20-12)15-11(18)7-19-10-5-3-4-9(14)6-10/h3-6,8H,7H2,1-2H3,(H,15,17,18)
InChIKey
IXHZNZGAOSSPOB-UHFFFAOYSA-N
Synonyms
370851-97-1
2(3bromophenoxy)N((2E)5(propan2yl)134thiadiazol2(3H)ylidene)acetamide
370851971
Brc1cccc(c1)OCC(=O)N=c1(nH)nc(s1)C(C)C
MFCD07200518
ZINC000009109770

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Available files

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