Vitas-M small molecule compound

6-(4-tert-butylphenyl)-3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL300152
SMILES COc1cc(ccc1OC)c1nnc2n1nc(s2)c1ccc(cc1)C(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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-21(2,3)15-9-6-13(7-10-15)19-24-25-18(22-23-20(25)28-19)14-8-11-16(26-4)17(12-14)27-5/h6-12H,1-5H3
InChIKey
ZQTZFUFCPLLWOJ-UHFFFAOYSA-N
Synonyms
577981-39-6
4(6(4(TERTBUTYL)PHENYL)(124TRIAZOLO(34B)134THIADIAZOLIN3YL))12DIMETHOXYBENZENE
577981396
6(4(tertbutyl)phenyl)3(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
6(4tertbutylphenyl)3(34dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC(=C(C=C4)OC)OC
InChI=1SC21H22N4O2Sc121(23)159613(71015)19242518(222320(25)2819)1481116(264)17(1214)275h612H15H3
MFCD04021514
ZINC000002323319
ZINC02323319
ZINC2323319

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Available files

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