Vitas-M small molecule compound

2-chloro-N-{(E)-[(3-chloro-4-fluorophenyl)amino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-5-nitrobenzamide

Catalog ID
STK131024
SMILES Cc1nc(N/C(=N/C(=O)c2cc(ccc2Cl)[N+](=O)[O-])/Nc2ccc(c(c2)Cl)F)nc(c1)C

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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 C20H15Cl2FN6O3 MW 477.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2FN6O3/c1-10-7-11(2)25-19(24-10)28-20(26-12-3-6-17(23)16(22)8-12)27-18(30)14-9-13(29(31)32)4-5-15(14)21/h3-9H,1-2H3,(H2,24,25,26,27,28,30)
InChIKey
XVYFUFAIYPYMCY-UHFFFAOYSA-N
Synonyms
577981-34-1
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((3CHLORO4FLUOROPHENYL)AMINO)1(2CHLORO5NITROPHENYL)2AZAPROP2EN1ONE
(E)2chloroN(((3chloro4fluorophenyl)amino)((46dimethylpyrimidin2yl)amino)methylene)5nitrobenzamide
2CHLORON((1Z)((3CHLORO4FLUOROPHENYL)AMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)5NITROBENZAMIDE
2CHLORON((3CHLORO4FLUOROANILINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)5NITROBENZAMIDE
2CHLORON((E)((3CHLORO4FLUOROPHENYL)AMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)5NITROBENZAMIDE
2CHLORON(N(3CHLORO4FLUOROPHENYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)5NITROBENZAMIDE
CC1=CC(=NC(=N1)NC(=NC(=O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl)NC3=CC(=C(C=C3)F)Cl)C
Cc1nc(NC(=NC(=O)c2cc(ccc2Cl)(N+)(=O)(O))Nc2ccc(c(c2)Cl)F)nc(c1)C
InChI=1SC20H15Cl2FN6O3c110711(2)2519(2410)2820(26123617(23)16(22)812)2718(30)14913(29(31)32)4515(14)21h39H12H3(H2242526272830)
MFCD04021510
ZINC9424138

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Available files

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