Vitas-M small molecule compound
3-({[(5-bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid
Catalog ID
STK101781
SMILES COc1ccc(cc1C(=O)NC(=S)Nc1cc(ccc1C)C(=O)O)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 C17H15BrN2O4S MW 423.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O4S/c1-9-3-4-10(16(22)23)7-13(9)19-17(25)20-15(21)12-8-11(18)5-6-14(12)24-2/h3-8H,1-2H3,(H,22,23)(H2,19,20,21,25)InChIKey
GOBUVTKGBKAXIR-UHFFFAOYSA-NSynonyms
433708-01-13((((5BROMO2METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)4METHYLBENZOICACID
3(((5BROMO2METHOXYBENZOYL)CARBAMOTHIOYL)AMINO)4METHYLBENZOICACID
3((5BROMO2METHOXYBENZOYL)CARBAMOTHIOYLAMINO)4METHYLBENZOICACID
433708011
CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC
InChI=1SC17H15BrN2O4Sc193410(16(22)23)713(9)1917(25)2015(21)12811(18)5614(12)242h38H12H3(H2223)(H219202125)
MFCD03244369
ZINC000001156512
ZINC1156512
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