Vitas-M small molecule compound
4-({[(3-bromo-4-methoxyphenyl)carbonyl]carbamothioyl}amino)-2-chlorobenzoic acid
Catalog ID
STK033691
SMILES COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O
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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 C16H12BrClN2O4S MW 443.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrClN2O4S/c1-24-13-5-2-8(6-11(13)17)14(21)20-16(25)19-9-3-4-10(15(22)23)12(18)7-9/h2-7H,1H3,(H,22,23)(H2,19,20,21,25)InChIKey
WASBQGUBQIYBRA-UHFFFAOYSA-NSynonyms
535979-30-74((((3BROMO4METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2CHLOROBENZOICACID
4(((3BROMO4METHOXYBENZOYL)CARBAMOTHIOYL)AMINO)2CHLOROBENZOICACID
4((3BROMO4METHOXYBENZOYL)CARBAMOTHIOYLAMINO)2CHLOROBENZOICACID
4(3(3bromo4methoxybenzoyl)thioureido)2chlorobenzoicacid
535979307
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)O)Cl)Br
COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O
InChI=1SC16H12BrClN2O4Sc12413528(611(13)17)14(21)2016(25)1993410(15(22)23)12(18)79h27H1H3(H2223)(H219202125)
MFCD03453826
STK033691
ZINC000001160033
ZINC1160033
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