Vitas-M small molecule compound

1-({6-[2-(3,4-dimethoxyphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzimidazole

Catalog ID
STK617663
SMILES COc1cc(CCc2nn3c(s2)nnc3Cn2cnc3c2cccc3)ccc1OC

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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 C21H20N6O2S MW 420.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2S/c1-28-17-9-7-14(11-18(17)29-2)8-10-20-25-27-19(23-24-21(27)30-20)12-26-13-22-15-5-3-4-6-16(15)26/h3-7,9,11,13H,8,10,12H2,1-2H3
InChIKey
GAWCDWWKIUOEQW-UHFFFAOYSA-N
Synonyms
951926-95-7
1((6(2(34dimethoxyphenyl)ethyl)(124)triazolo(34b)(134)thiadiazol3yl)methyl)1Hbenzimidazole
3((1Hbenzo(d)imidazol1yl)methyl)6(34dimethoxyphenethyl)(124)triazolo(34b)(134)thiadiazole
3(benzimidazol1ylmethyl)6(2(34dimethoxyphenyl)ethyl)(124)triazolo(34b)(134)thiadiazole
951926957
COC1=C(C=C(C=C1)CCC2=NN3C(=NN=C3S2)CN4C=NC5=CC=CC=C54)OC
InChI=1SC21H20N6O2Sc128179714(1118(17)292)81020252719(232421(27)3020)1226132215534616(15)26h3791113H81012H212H3
MFCD09856076
ZINC000013724727
ZINC13724727

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Available files

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