Vitas-M small molecule compound
3-bromo-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-4-methoxybenzamide
Catalog ID
STK120632
SMILES COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1O)[N+](=O)[O-]
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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 C15H12BrN3O5S MW 426.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12BrN3O5S/c1-24-13-5-2-8(6-10(13)16)14(21)18-15(25)17-11-4-3-9(19(22)23)7-12(11)20/h2-7,20H,1H3,(H2,17,18,21,25)InChIKey
QEWYOVOCJHXFKF-UHFFFAOYSA-NSynonyms
3BROMON((2HYDROXY4NITROPHENYL)CARBAMOTHIOYL)4METHOXYBENZAMIDE
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))O)Br
COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1O)(N+)(=O)(O)
InChI=1SC15H12BrN3O5Sc12413528(610(13)16)14(21)1815(25)1711439(19(22)23)712(11)20h2720H1H3(H217182125)
MFCD03588876
ZINC000009805660
ZINC09805660
ZINC9805660
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Check stock on Vitas-MAvailable files
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