Vitas-M small molecule compound
2-({[(3-bromo-4-ethoxyphenyl)carbonyl]carbamothioyl}amino)-5-chlorobenzoic acid
Catalog ID
STK012342
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1C(=O)O)Cl
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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 C17H14BrClN2O4S MW 457.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrClN2O4S/c1-2-25-14-6-3-9(7-12(14)18)15(22)21-17(26)20-13-5-4-10(19)8-11(13)16(23)24/h3-8H,2H2,1H3,(H,23,24)(H2,20,21,22,26)InChIKey
ILKRDFAPEZNBQM-UHFFFAOYSA-NSynonyms
531515-38-52((((3BROMO4ETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)5CHLOROBENZOICACID
2((3BROMO4ETHOXYBENZOYL)CARBAMOTHIOYLAMINO)5CHLOROBENZOICACID
531515385
BENZOICACID2((((3BROMO4ETHOXYBENZOYL)AMINO)THIOXOMETHYL)AMINO)5CHLORO
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)C(=O)O)Br
CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1C(=O)O)Cl
InChI=1SC17H14BrClN2O4Sc122514639(712(14)18)15(22)2117(26)20135410(19)811(13)16(23)24h38H2H21H3(H2324)(H220212226)
MFCD03565477
STK012342
ZINC000008983481
ZINC8983481
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