Vitas-M small molecule compound
2,6-dibromo-4-(morpholin-4-ylcarbonothioyl)phenyl 2,4-dinitrobenzoate
Catalog ID
STK674922
SMILES Brc1cc(cc(c1OC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Br)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 C18H13Br2N3O7S MW 575.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Br2N3O7S/c19-13-7-10(17(31)21-3-5-29-6-4-21)8-14(20)16(13)30-18(24)12-2-1-11(22(25)26)9-15(12)23(27)28/h1-2,7-9H,3-6H2InChIKey
MWMFTSXZXXNQME-UHFFFAOYSA-NSynonyms
(26DIBROMO4(MORPHOLINE4CARBOTHIOYL)PHENYL)24DINITROBENZOATE
26dibromo4(morpholin4ylcarbonothioyl)phenyl24dinitrobenzoate
Brc1cc(cc(c1OC(=O)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))Br)C(=S)N1CCOCC1
C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))Br
InChI=1SC18H13Br2N3O7Sc1913710(17(31)2135296421)814(20)16(13)3018(24)122111(22(25)26)915(12)23(27)28h1279H36H2
MFCD01062332
ZINC000033353588
ZINC33353588
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