Vitas-M small molecule compound
2-(4-bromo-2-chlorophenoxy)-N-[(4-chloro-3-nitrophenyl)carbamothioyl]acetamide
Catalog ID
STK115825
SMILES O=C(NC(=S)Nc1ccc(c(c1)[N+](=O)[O-])Cl)COc1ccc(cc1Cl)Br
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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 C15H10BrCl2N3O4S MW 479.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10BrCl2N3O4S/c16-8-1-4-13(11(18)5-8)25-7-14(22)20-15(26)19-9-2-3-10(17)12(6-9)21(23)24/h1-6H,7H2,(H2,19,20,22,26)InChIKey
JWTBFMHYEWYGKL-UHFFFAOYSA-NSynonyms
2(4BROMO2CHLOROPHENOXY)N((4CHLORO3NITROPHENYL)CARBAMOTHIOYL)ACETAMIDE
C1=CC(=C(C=C1NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl)(N+)(=O)(O))Cl
InChI=1SC15H10BrCl2N3O4Sc1681413(11(18)58)25714(22)2015(26)1992310(17)12(69)21(23)24h16H7H2(H219202226)
MFCD03623057
O=C(NC(=S)Nc1ccc(c(c1)(N+)(=O)(O))Cl)COc1ccc(cc1Cl)Br
ZINC000009805344
ZINC09805344
ZINC9805344
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