Vitas-M small molecule compound
3-benzyl-6-[(4-bromophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK192032
SMILES Brc1ccc(cc1)OCc1nn2c(s1)nnc2Cc1ccccc1
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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 C17H13BrN4OS MW 401.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN4OS/c18-13-6-8-14(9-7-13)23-11-16-21-22-15(19-20-17(22)24-16)10-12-4-2-1-3-5-12/h1-9H,10-11H2InChIKey
GJMLMFYLSPNDBX-UHFFFAOYSA-NSynonyms
(3BENZYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)METHYL4BROMOPHENYLETHER
3BENZYL6((4BROMOPHENOXY)METHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
C1=CC=C(C=C1)CC2=NN=C3N2N=C(S3)COC4=CC=C(C=C4)Br
InChI=1SC17H13BrN4OSc18136814(9713)231116212215(192017(22)2416)10124213512h19H1011H2
MFCD05088181
ZINC000004664888
ZINC04664888
ZINC4664888
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