Vitas-M small molecule compound

1-(2,4-dimethoxyphenyl)-2-{[1-(2,5-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}ethanone

Catalog ID
STL112254
SMILES COc1cc(OC)ccc1C(=O)CSc1nnnn1c1cc(C)ccc1C

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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 C19H20N4O3S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3S/c1-12-5-6-13(2)16(9-12)23-19(20-21-22-23)27-11-17(24)15-8-7-14(25-3)10-18(15)26-4/h5-10H,11H2,1-4H3
InChIKey
WJNUANUSEOIBIY-UHFFFAOYSA-N
Synonyms

1(24dimethoxyphenyl)2((1(25dimethylphenyl)1Htetrazol5yl)sulfanyl)ethanone
1(24DIMETHOXYPHENYL)2(1(25DIMETHYLPHENYL)TETRAZOL5YL)SULFANYLETHANONE
CC1=CC(=C(C=C1)C)N2C(=NN=N2)SCC(=O)C3=C(C=C(C=C3)OC)OC
InChI=1SC19H20N4O3Sc1125613(2)16(912)2319(20212223)271117(24)158714(253)1018(15)264h510H11H214H3
MFCD02073702
ZINC000005927949
ZINC05927949
ZINC5927949

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Available files

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