Vitas-M small molecule compound

{3-bromo-4-[(4-nitrobenzyl)oxy]phenyl}(morpholin-4-yl)methanethione

Catalog ID
STL411898
SMILES Brc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])C(=S)N1CCOCC1

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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 C18H17BrN2O4S MW 437.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN2O4S/c19-16-11-14(18(26)20-7-9-24-10-8-20)3-6-17(16)25-12-13-1-4-15(5-2-13)21(22)23/h1-6,11H,7-10,12H2
InChIKey
GHXZNXBJKUNKRL-UHFFFAOYSA-N
Synonyms

(3bromo4((4nitrobenzyl)oxy)phenyl)(morpholin4yl)methanethione
(3BROMO4((4NITROPHENYL)METHOXY)PHENYL)MORPHOLIN4YLMETHANETHIONE
Brc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C(=S)N1CCOCC1
C1COCCN1C(=S)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC18H17BrN2O4Sc19161114(18(26)20792410820)3617(16)2512131415(5213)21(22)23h1611H71012H2
MFCD30706769
ZINC000034836323
ZINC34836323

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Available files

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