Vitas-M small molecule compound

1-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-phenyl-1-prop-2-en-1-ylthiourea

Catalog ID
STK321798
SMILES COc1ccc(cc1)c1noc(n1)CN(C(=S)Nc1ccccc1)CC=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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-3-13-24(20(27)21-16-7-5-4-6-8-16)14-18-22-19(23-26-18)15-9-11-17(25-2)12-10-15/h3-12H,1,13-14H2,2H3,(H,21,27)
InChIKey
JOPHOCUZBQNWSK-UHFFFAOYSA-N
Synonyms

1((3(4methoxyphenyl)124oxadiazol5yl)methyl)3phenyl1prop2en1ylthiourea
1((3(4methoxyphenyl)124oxadiazol5yl)methyl)3phenyl1prop2enylthiourea
COC1=CC=C(C=C1)C2=NOC(=N2)CN(CC=C)C(=S)NC3=CC=CC=C3
InChI=1SC20H20N4O2Sc131324(20(27)21167546816)14182219(232618)1591117(252)121015h312H11314H22H3(H2127)
MFCD07088320
ZINC000012654302
ZINC12654302

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Available files

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