Vitas-M small molecule compound
{3-chloro-4-[(4-nitrobenzyl)oxy]phenyl}(morpholin-4-yl)methanethione
Catalog ID
STL411892
SMILES Clc1cc(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 C18H17ClN2O4S MW 392.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O4S/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,7-10,12H2InChIKey
GIYLIAAHVULFDF-UHFFFAOYSA-NSynonyms
(3chloro4((4nitrobenzyl)oxy)phenyl)(morpholin4yl)methanethione
(3CHLORO4((4NITROPHENYL)METHOXY)PHENYL)MORPHOLIN4YLMETHANETHIONE
C1COCCN1C(=S)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Cl
Clc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C(=S)N1CCOCC1
InChI=1SC18H17ClN2O4Sc19161114(18(26)20792410820)3617(16)2512131415(5213)21(22)23h1611H71012H2
MFCD05998287
ZINC000001072932
ZINC01072932
ZINC1072932
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