Vitas-M small molecule compound
1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N,N'-diethylcarbamimidothioate
Catalog ID
STK754037
SMILES CCCCCCOc1ccc(cc1)N1C(=O)CC(C1=O)S/C(=N\CC)/NCC
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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 C21H31N3O3S MW 405.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O3S/c1-4-7-8-9-14-27-17-12-10-16(11-13-17)24-19(25)15-18(20(24)26)28-21(22-5-2)23-6-3/h10-13,18H,4-9,14-15H2,1-3H3,(H,22,23)InChIKey
SINCGSIIDIPGQV-UHFFFAOYSA-NSynonyms
(1(4HEXOXYPHENYL)25DIOXOPYRROLIDIN3YL)NNDIETHYLCARBAMIMIDOTHIOATE
1(4(hexyloxy)phenyl)25dioxopyrrolidin3ylNNdiethylcarbamimidothioate
1(4(HEXYLOXY)PHENYL)25DIOXOPYRROLIDIN3YLNNDIETHYLIMIDOTHIOCARBAMATE
CCCCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC(=NCC)NCC
CCCCCCOc1ccc(cc1)N1C(=O)CC(C1=O)SC(=NCC)NCC
InChI=1SC21H31N3O3Sc14789142717121016(111317)2419(25)1518(20(24)26)2821(2252)2363h101318H491415H213H3(H2223)
MFCD00759044
ZINC000013144056
ZINC000100050731
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