Vitas-M small molecule compound
2-(2-bromo-4-methylphenoxy)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]acetamide
Catalog ID
STK123391
SMILES O=C(NC(=S)Nc1ccc(cc1C)[N+](=O)[O-])COc1ccc(cc1Br)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 C17H16BrN3O4S MW 438.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN3O4S/c1-10-3-6-15(13(18)7-10)25-9-16(22)20-17(26)19-14-5-4-12(21(23)24)8-11(14)2/h3-8H,9H2,1-2H3,(H2,19,20,22,26)InChIKey
WKGAXMQZURFHQM-UHFFFAOYSA-NSynonyms
2(2BROMO4METHYLPHENOXY)N((2METHYL4NITROPHENYL)CARBAMOTHIOYL)ACETAMIDE
CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))C)Br
InChI=1SC17H16BrN3O4Sc1103615(13(18)710)25916(22)2017(26)19145412(21(23)24)811(14)2h38H9H212H3(H219202226)
MFCD03589105
O=C(NC(=S)Nc1ccc(cc1C)(N+)(=O)(O))COc1ccc(cc1Br)C
ZINC000009805889
ZINC09805889
ZINC9805889
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