Vitas-M small molecule compound
(5E)-5-{5-bromo-2-[(2-nitrobenzyl)oxy]benzylidene}-2-imino-1,3-thiazolidin-4-one
Catalog ID
STL367570
SMILES N=C1NC(=O)/C(=C\c2cc(Br)ccc2OCc2ccccc2[N+](=O)[O-])/S1
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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 C17H12BrN3O4S MW 434.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrN3O4S/c18-12-5-6-14(11(7-12)8-15-16(22)20-17(19)26-15)25-9-10-3-1-2-4-13(10)21(23)24/h1-8H,9H2,(H2,19,20,22)/b15-8+InChIKey
RSEDZQUXRWWWEC-OVCLIPMQSA-NSynonyms
(5E)2amino5((5bromo2((2nitrophenyl)methoxy)phenyl)methylidene)13thiazol4one
(5E)5(5bromo2((2nitrobenzyl)oxy)benzylidene)2imino13thiazolidin4one
C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C=C3C(=O)N=C(S3)N)(N+)(=O)(O)
InChI=1SC17H12BrN3O4Sc18125614(11(712)81516(22)2017(19)2615)25910312413(10)21(23)24h18H9H2(H2192022)b158+
MFCD28951849
N=C1NC(=O)C(=Cc2cc(Br)ccc2OCc2ccccc2(N+)(=O)(O))S1
ZINC000033743496
ZINC33743496
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