Vitas-M small molecule compound
3-chloro-4-methoxy-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK729829
SMILES COc1cc(ccc1NC(=S)NC(=O)c1ccc(c(c1)Cl)OC)[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 C16H14ClN3O5S MW 395.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O5S/c1-24-13-6-3-9(7-11(13)17)15(21)19-16(26)18-12-5-4-10(20(22)23)8-14(12)25-2/h3-8H,1-2H3,(H2,18,19,21,26)InChIKey
ISZHYRQHXVDCRY-UHFFFAOYSA-NSynonyms
3chloro4methoxyN((2methoxy4nitrophenyl)carbamothioyl)benzamide
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))OC)Cl
COc1cc(ccc1NC(=S)NC(=O)c1ccc(c(c1)Cl)OC)(N+)(=O)(O)
InChI=1SC16H14ClN3O5Sc12413639(711(13)17)15(21)1916(26)18125410(20(22)23)814(12)252h38H12H3(H218192126)
MFCD02625220
ZINC000004819810
ZINC04819810
ZINC4819810
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