Vitas-M small molecule compound
2-{[2-ethoxy-4-(pyrrolidin-1-ylcarbonothioyl)phenoxy]methyl}benzonitrile
Catalog ID
STL376423
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)C(=S)N1CCCC1
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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 C21H22N2O2S MW 366.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S/c1-2-24-20-13-16(21(26)23-11-5-6-12-23)9-10-19(20)25-15-18-8-4-3-7-17(18)14-22/h3-4,7-10,13H,2,5-6,11-12,15H2,1H3InChIKey
GHLVTHFWZODYCU-UHFFFAOYSA-NSynonyms
2((2ethoxy4(pyrrolidin1ylcarbonothioyl)phenoxy)methyl)benzonitrile
2((2ETHOXY4(PYRROLIDINE1CARBOTHIOYL)PHENOXY)METHYL)BENZONITRILE
CCOC1=C(C=CC(=C1)C(=S)N2CCCC2)OCC3=CC=CC=C3C#N
InChI=1SC21H22N2O2Sc1224201316(21(26)2311561223)91019(20)251518843717(18)1422h3471013H256111215H21H3
MFCD05998294
ZINC000001072964
ZINC01072964
ZINC1072964
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