Vitas-M small molecule compound
4-({[(3-bromo-4-ethoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid
Catalog ID
STK107659
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)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 C17H15BrN2O4S MW 423.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O4S/c1-2-24-14-8-5-11(9-13(14)18)15(21)20-17(25)19-12-6-3-10(4-7-12)16(22)23/h3-9H,2H2,1H3,(H,22,23)(H2,19,20,21,25)InChIKey
BUYVUSMIXYZXJJ-UHFFFAOYSA-NSynonyms
4((((3BROMO4ETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4((3BROMO4ETHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O)Br
InChI=1SC17H15BrN2O4Sc1224148511(913(14)18)15(21)2017(25)19126310(4712)16(22)23h39H2H21H3(H2223)(H219202125)
MFCD03030646
ZINC000001151770
ZINC1151770
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