Vitas-M small molecule compound

6-(4-methoxyphenyl)-3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK508255
SMILES COc1ccc(cc1)c1nn2c(s1)nnc2COc1ccc(cc1)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 C18H16N4O2S MW 352.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S/c1-12-3-7-15(8-4-12)24-11-16-19-20-18-22(16)21-17(25-18)13-5-9-14(23-2)10-6-13/h3-10H,11H2,1-2H3
InChIKey
LCSJHVJCBNITCZ-UHFFFAOYSA-N
Synonyms

1((6(4METHOXYPHENYL)(124TRIAZOLO(34B)134THIADIAZOLIN3YL))METHOXY)4METHYLBENZENE
6(4methoxyphenyl)3((4methylphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
CC1=CC=C(C=C1)OCC2=NN=C3N2N=C(S3)C4=CC=C(C=C4)OC
InChI=1SC18H16N4O2Sc1123715(8412)24111619201822(16)2117(2518)135914(232)10613h310H11H212H3
MFCD07428999
ZINC000005032306
ZINC05032306
ZINC5032306

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Available files

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