Vitas-M small molecule compound
1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl N'-1,3-benzodioxol-5-yl-N-ethylcarbamimidothioate
Catalog ID
STK760188
SMILES CCN/C(=N\c1ccc2c(c1)OCO2)/SC1CC(=O)N(C1=O)c1ccccc1F
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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 C20H18FN3O4S MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FN3O4S/c1-2-22-20(23-12-7-8-15-16(9-12)28-11-27-15)29-17-10-18(25)24(19(17)26)14-6-4-3-5-13(14)21/h3-9,17H,2,10-11H2,1H3,(H,22,23)InChIKey
CUKKVGBNYCHXHR-UHFFFAOYSA-NSynonyms
(1(2FLUOROPHENYL)25DIOXOPYRROLIDIN3YL)N(13BENZODIOXOL5YL)NETHYLCARBAMIMIDOTHIOATE
(3R)1(2FLUOROPHENYL)25DIOXOPYRROLIDIN3YLN13BENZODIOXOL5YLNETHYLCARBAMIMIDOTHIOATE
1(2fluorophenyl)25dioxopyrrolidin3ylN13benzodioxol5ylNethylcarbamimidothioate
CCN=C(NC1=CC2=C(C=C1)OCO2)SC3CC(=O)N(C3=O)C4=CC=CC=C4F
CCNC(=Nc1ccc2c(c1)OCO2)SC1CC(=O)N(C1=O)c1ccccc1F
InChI=1SC20H18FN3O4Sc122220(2312781516(912)28112715)29171018(25)24(19(17)26)14643513(14)21h3917H21011H21H3(H2223)
MFCD01572092
ZINC000018043057
ZINC000100077851
ZINC04458236
ZINC04458237
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