Vitas-M small molecule compound
methyl 2-({[(2,3,5,6-tetrafluoro-4-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STK520301
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)c1c(F)c(F)c(c(c1F)F)OC
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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 C17H12F4N2O4S MW 416.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F4N2O4S/c1-26-14-12(20)10(18)9(11(19)13(14)21)15(24)23-17(28)22-8-6-4-3-5-7(8)16(25)27-2/h3-6H,1-2H3,(H2,22,23,24,28)InChIKey
XEXBNDLPUMUWQS-UHFFFAOYSA-NSynonyms
COC1=C(C(=C(C(=C1F)F)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC)F)F
InChI=1SC17H12F4N2O4Sc1261412(20)10(18)9(11(19)13(14)21)15(24)2317(28)22864357(8)16(25)272h36H12H3(H222232428)
methyl2((((2356tetrafluoro4methoxyphenyl)carbonyl)carbamothioyl)amino)benzoate
methyl2((2356tetrafluoro4methoxybenzoyl)carbamothioylamino)benzoate
MFCD05848710
ZINC000001067808
ZINC01067808
ZINC1067808
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