Vitas-M small molecule compound
4-chloro-3-({[(4-chloro-3-methylphenoxy)acetyl]carbamothioyl}amino)benzoic acid
Catalog ID
STK000344
SMILES O=C(NC(=S)Nc1cc(ccc1Cl)C(=O)O)COc1ccc(c(c1)C)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 C17H14Cl2N2O4S MW 413.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2N2O4S/c1-9-6-11(3-5-12(9)18)25-8-15(22)21-17(26)20-14-7-10(16(23)24)2-4-13(14)19/h2-7H,8H2,1H3,(H,23,24)(H2,20,21,22,26)InChIKey
XWFREYJZZZQSLL-UHFFFAOYSA-NSynonyms
532421-00-44CHLORO3((((4CHLORO3METHYLPHENOXY)ACETYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4CHLORO3((2(4CHLORO3METHYLPHENOXY)ACETYL)CARBAMOTHIOYLAMINO)BENZOICACID
532421004
BENZOICACID4CHLORO3(((((4CHLORO3METHYLPHENOXY)ACETYL)AMINO)THIOXOMETHYL)AMINO)
CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)Cl)Cl
InChI=1SC17H14Cl2N2O4Sc19611(3512(9)18)25815(22)2117(26)2014710(16(23)24)2413(14)19h27H8H21H3(H2324)(H220212226)
MFCD03568223
O=C(NC(=S)Nc1cc(ccc1Cl)C(=O)O)COc1ccc(c(c1)C)Cl
STK000344
ZINC000004546549
ZINC4546549
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