Vitas-M small molecule compound
3-({[(4-chlorophenoxy)acetyl]carbamothioyl}amino)-2-methylbenzoic acid
Catalog ID
STK029684
SMILES O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1ccc(cc1)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 C17H15ClN2O4S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2O4S/c1-10-13(16(22)23)3-2-4-14(10)19-17(25)20-15(21)9-24-12-7-5-11(18)6-8-12/h2-8H,9H2,1H3,(H,22,23)(H2,19,20,21,25)InChIKey
HFUCLVCTSKCQKA-UHFFFAOYSA-NSynonyms
434308-44-83((((4CHLOROPHENOXY)ACETYL)CARBAMOTHIOYL)AMINO)2METHYLBENZOICACID
3((2(4CHLOROPHENOXY)ACETYL)CARBAMOTHIOYLAMINO)2METHYLBENZOICACID
434308448
BENZOICACID3(((((4CHLOROPHENOXY)ACETYL)AMINO)THIOXOMETHYL)AMINO)2METHYL
CC1=C(C=CC=C1NC(=S)NC(=O)COC2=CC=C(C=C2)Cl)C(=O)O
InChI=1SC17H15ClN2O4Sc11013(16(22)23)32414(10)1917(25)2015(21)924127511(18)6812h28H9H21H3(H2223)(H219202125)
MFCD03572804
O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1ccc(cc1)Cl
STK029684
ZINC000001159559
ZINC1159559
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