Vitas-M small molecule compound
N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK050217
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(ccc1F)[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 C15H11FN4O6S MW 394.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11FN4O6S/c1-26-13-5-2-8(6-12(13)20(24)25)14(21)18-15(27)17-11-7-9(19(22)23)3-4-10(11)16/h2-7H,1H3,(H2,17,18,21,27)InChIKey
PNAIHBMYFYXCMR-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)(N+)(=O)(O))F)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cc(ccc1F)(N+)(=O)(O)
InChI=1SC15H11FN4O6Sc12613528(612(13)20(24)25)14(21)1815(27)171179(19(22)23)3410(11)16h27H1H3(H217182127)
MFCD02625228
N((2FLUORO5NITROPHENYL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N(2FLUORO5NITROPHENYL)N(3NITRO4METHOXYBENZOYL)THIOUREA
STK050217
ZINC000002053749
ZINC02053749
ZINC2053749
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