Vitas-M small molecule compound
3-chloro-N-[(4-chloro-3-nitrophenyl)carbamothioyl]-4-methoxybenzamide
Catalog ID
STK016287
SMILES COc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(c(c1)[N+](=O)[O-])Cl
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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 C15H11Cl2N3O4S MW 400.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11Cl2N3O4S/c1-24-13-5-2-8(6-11(13)17)14(21)19-15(25)18-9-3-4-10(16)12(7-9)20(22)23/h2-7H,1H3,(H2,18,19,21,25)InChIKey
NJTAMMHKZBXUHQ-UHFFFAOYSA-NSynonyms
3CHLORON((4CHLORO3NITROPHENYL)CARBAMOTHIOYL)4METHOXYBENZAMIDE
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)(N+)(=O)(O))Cl
COc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC15H11Cl2N3O4Sc12413528(611(13)17)14(21)1915(25)1893410(16)12(79)20(22)23h27H1H3(H218192125)
MFCD02625169
STK016287
ZINC000002303392
ZINC02303392
ZINC2303392
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