Vitas-M small molecule compound

3-(azepan-1-ylmethyl)-6-(3-ethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL086151
SMILES CCOc1cccc(c1)c1nn2c(s1)nnc2CN1CCCCCC1

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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 C18H23N5OS MW 357.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5OS/c1-2-24-15-9-7-8-14(12-15)17-21-23-16(19-20-18(23)25-17)13-22-10-5-3-4-6-11-22/h7-9,12H,2-6,10-11,13H2,1H3
InChIKey
WSKUHAKIJPMMDD-UHFFFAOYSA-N
Synonyms

3(3(1AZEPANYLMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PHENYLETHYLETHER
3(azepan1ylmethyl)6(3ethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
CCOC1=CC=CC(=C1)C2=NN3C(=NN=C3S2)CN4CCCCCC4
InChI=1SC18H23N5OSc12241597814(1215)17212316(192018(23)2517)13221053461122h7912H26101113H21H3
MFCD18203602
ZINC000057524574
ZINC57524574

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Available files

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