Vitas-M small molecule compound
1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-ethylcarbamimidothioate
Catalog ID
STK676555
SMILES CC/N=C(/Nc1ccc(cc1)OC(Cl)(F)F)\SC1CC(=O)N(C1=O)c1ccc(cc1)I
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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 C20H17ClF2IN3O3S MW 579.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF2IN3O3S/c1-2-25-19(26-13-5-9-15(10-6-13)30-20(21,22)23)31-16-11-17(28)27(18(16)29)14-7-3-12(24)4-8-14/h3-10,16H,2,11H2,1H3,(H,25,26)InChIKey
KNNQBDQWPUNFQK-UHFFFAOYSA-NSynonyms
(1(4IODOPHENYL)25DIOXOPYRROLIDIN3YL)N(4(CHLORO(DIFLUORO)METHOXY)PHENYL)NETHYLCARBAMIMIDOTHIOATE
1(4iodophenyl)25dioxopyrrolidin3ylN(4(chloro(difluoro)methoxy)phenyl)Nethylcarbamimidothioate
CCN=C(NC1=CC=C(C=C1)OC(F)(F)Cl)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)I
CCN=C(Nc1ccc(cc1)OC(Cl)(F)F)SC1CC(=O)N(C1=O)c1ccc(cc1)I
InChI=1SC20H17ClF2IN3O3Sc122519(26135915(10613)3020(2122)23)31161117(28)27(18(16)29)147312(24)4814h31016H211H21H3(H2526)
MFCD02110690
ZINC000098003552
ZINC000100092286
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