Vitas-M small molecule compound

2-[(4-tert-butylbenzyl)sulfanyl]-5-[(4-methoxybenzyl)sulfanyl]-1,3,4-thiadiazole

Catalog ID
STK049469
SMILES COc1ccc(cc1)CSc1nnc(s1)SCc1ccc(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 C21H24N2OS3 MW 416.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS3/c1-21(2,3)17-9-5-15(6-10-17)13-25-19-22-23-20(27-19)26-14-16-7-11-18(24-4)12-8-16/h5-12H,13-14H2,1-4H3
InChIKey
COEBNXSXONQDDE-UHFFFAOYSA-N
Synonyms
499103-82-1
1((5((4(TERTBUTYL)PHENYL)METHYLTHIO)(134THIADIAZOL2YLTHIO))METHYL)4METHOXYBENZENE
2(((4TERTBUTYLPHENYL)METHYL)SULFANYL)5(((4METHOXYPHENYL)METHYL)SULFANYL)134THIADIAZOLE
2((4(tertbutyl)benzyl)thio)5((4methoxybenzyl)thio)134thiadiazole
2((4TERTBUTYLBENZYL)SULFANYL)5((4METHOXYBENZYL)SULFANYL)134THIADIAZOLE
2((4TERTBUTYLPHENYL)METHYLSULFANYL)5((4METHOXYPHENYL)METHYLSULFANYL)134THIADIAZOLE
499103821
CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=CC=C(C=C3)OC
COc1ccc(cc1)CSc1nnc(s1)SCc1ccc(cc1)C(C)(C)C
InChI=1SC21H24N2OS3c121(23)179515(61017)132519222320(2719)26141671118(244)12816h512H1314H214H3
MFCD03474146
STK049469
ZINC000001896308
ZINC01896308
ZINC1896308

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Available files

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