Vitas-M small molecule compound
3-({[(3,5-dimethylphenoxy)acetyl]carbamothioyl}amino)-2-methylbenzoic acid
Catalog ID
STK090627
SMILES O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1cc(C)cc(c1)C
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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 C19H20N2O4S MW 372.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S/c1-11-7-12(2)9-14(8-11)25-10-17(22)21-19(26)20-16-6-4-5-15(13(16)3)18(23)24/h4-9H,10H2,1-3H3,(H,23,24)(H2,20,21,22,26)InChIKey
ATNQVTDGRBHJOH-UHFFFAOYSA-NSynonyms
535956-90-23((((35DIMETHYLPHENOXY)ACETYL)CARBAMOTHIOYL)AMINO)2METHYLBENZOICACID
3((2(35DIMETHYLPHENOXY)ACETYL)CARBAMOTHIOYLAMINO)2METHYLBENZOICACID
535956902
BENZOICACID3(((((35DIMETHYLPHENOXY)ACETYL)AMINO)THIOXOMETHYL)AMINO)2METHYL
CC1=CC(=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC(=C2C)C(=O)O)C
InChI=1SC19H20N2O4Sc111712(2)914(811)251017(22)2119(26)201664515(13(16)3)18(23)24h49H10H213H3(H2324)(H220212226)
MFCD03572408
O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1cc(C)cc(c1)C
STK090627
ZINC000006571481
ZINC6571481
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