Vitas-M small molecule compound
1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl N'-1,3-benzodioxol-5-yl-N-ethylcarbamimidothioate
Catalog ID
STL171281
SMILES CCN/C(=N\c1ccc2c(c1)OCO2)/SC1CC(=O)N(C1=O)c1ccc(cc1)Br
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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 C20H18BrN3O4S MW 476.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O4S/c1-2-22-20(23-13-5-8-15-16(9-13)28-11-27-15)29-17-10-18(25)24(19(17)26)14-6-3-12(21)4-7-14/h3-9,17H,2,10-11H2,1H3,(H,22,23)InChIKey
LVQXBTRFVGNWIM-UHFFFAOYSA-NSynonyms
354548-06-4(1(4BROMOPHENYL)25DIOXOPYRROLIDIN3YL)N(13BENZODIOXOL5YL)NETHYLCARBAMIMIDOTHIOATE
1(4BROMOPHENYL)25DIOXO3PYRROLIDINYLN(13BENZODIOXOL5YL)NETHYLIMIDOTHIOCARBAMATE
1(4bromophenyl)25dioxopyrrolidin3ylN13benzodioxol5ylNethylcarbamimidothioate
354548064
CCN=C(NC1=CC2=C(C=C1)OCO2)SC3CC(=O)N(C3=O)C4=CC=C(C=C4)Br
CCNC(=Nc1ccc2c(c1)OCO2)SC1CC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC20H18BrN3O4Sc122220(2313581516(913)28112715)29171018(25)24(19(17)26)146312(21)4714h3917H21011H21H3(H2223)
MFCD01835582
N(2H13BENZODIOXOL5YL)1((1(4BROMOPHENYL)25DIOXOPYRROLIDIN3YL)SULFANYL)NETHYLMETHANIMIDAMIDE
ZINC000008456704
ZINC000100651631
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