Vitas-M small molecule compound
(2E)-3-(2,4-dichlorophenyl)-N-[(2-fluoro-5-nitrophenyl)carbamothioyl]prop-2-enamide
Catalog ID
STK002516
SMILES S=C(Nc1cc(ccc1F)[N+](=O)[O-])NC(=O)/C=C/c1ccc(cc1Cl)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 C16H10Cl2FN3O3S MW 414.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Cl2FN3O3S/c17-10-3-1-9(12(18)7-10)2-6-15(23)21-16(26)20-14-8-11(22(24)25)4-5-13(14)19/h1-8H,(H2,20,21,23,26)/b6-2+InChIKey
WRCGHFFBQZROLD-QHHAFSJGSA-NSynonyms
(2E)3(24DICHLOROPHENYL)N((2FLUORO5NITROPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(24DICHLOROPHENYL)N((2FLUORO5NITROPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
C1=CC(=C(C=C1(N+)(=O)(O))NC(=S)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl)F
InChI=1SC16H10Cl2FN3O3Sc1710319(12(18)710)2615(23)2116(26)2014811(22(24)25)4513(14)19h18H(H220212326)b62+
MFCD02923170
S=C(Nc1cc(ccc1F)(N+)(=O)(O))NC(=O)C=Cc1ccc(cc1Cl)Cl
STK002516
ZINC000001181482
ZINC01181482
ZINC1181482
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