Vitas-M small molecule compound

3-{[(4-bromophenyl)amino]methyl}-5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione

Catalog ID
STK729255
SMILES Brc1ccc(cc1)NCn1nc(oc1=S)c1ccncc1

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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 C14H11BrN4OS MW 363.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11BrN4OS/c15-11-1-3-12(4-2-11)17-9-19-14(21)20-13(18-19)10-5-7-16-8-6-10/h1-8,17H,9H2
InChIKey
ASXHQISRYAKGMZ-UHFFFAOYSA-N
Synonyms

134OXADIAZOLE2(3H)THIONE3(((4BROMOPHENYL)AMINO)METHYL)5(4PYRIDINYL)
3(((4bromophenyl)amino)methyl)5(pyridin4yl)134oxadiazole2(3H)thione
3((4BROMOANILINO)METHYL)5PYRIDIN4YL134OXADIAZOLE2THIONE
C1=CC(=CC=C1NCN2C(=S)OC(=N2)C3=CC=NC=C3)Br
InChI=1SC14H11BrN4OSc15111312(4211)1791914(21)2013(1819)1057168610h1817H9H2
MFCD05854861
ZINC000001425695
ZINC01425695
ZINC1425695

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Available files

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