Vitas-M small molecule compound

1-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-methyl-3-(2-methylphenyl)thiourea

Catalog ID
STK321802
SMILES COc1cc(ccc1OC)c1noc(n1)CN(C(=S)Nc1ccccc1C)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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-13-7-5-6-8-15(13)21-20(28)24(2)12-18-22-19(23-27-18)14-9-10-16(25-3)17(11-14)26-4/h5-11H,12H2,1-4H3,(H,21,28)
InChIKey
QSDFENRVIYBYQI-UHFFFAOYSA-N
Synonyms

1((3(34dimethoxyphenyl)124oxadiazol5yl)methyl)1methyl3(2methylphenyl)thiourea
CC1=CC=CC=C1NC(=S)N(C)CC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC
InChI=1SC20H22N4O3Sc113756815(13)2120(28)24(2)12182219(232718)1491016(253)17(1114)264h511H12H214H3(H2128)
MFCD07088369
ZINC000012654321
ZINC12654321

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Available files

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