Vitas-M small molecule compound
4-ethoxy-N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
Catalog ID
STK023591
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccccc1F
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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 C16H14FN3O4S MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14FN3O4S/c1-2-24-14-8-7-10(9-13(14)20(22)23)15(21)19-16(25)18-12-6-4-3-5-11(12)17/h3-9H,2H2,1H3,(H2,18,19,21,25)InChIKey
KRPPSLLPAJLQDY-UHFFFAOYSA-NSynonyms
4ETHOXYN((2FLUOROPHENYL)CARBAMOTHIOYL)3NITROBENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2F)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccccc1F
InChI=1SC16H14FN3O4Sc1224148710(913(14)20(22)23)15(21)1916(25)1812643511(12)17h39H2H21H3(H218192125)
MFCD02626956
STK023591
ZINC000001172438
ZINC01172438
ZINC1172438
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