Vitas-M small molecule compound
N-{(E)-{[2-chloro-5-(trifluoromethyl)phenyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}benzamide
Catalog ID
STK082531
SMILES Cc1nc(N/C(=N/C(=O)c2ccccc2)/Nc2cc(ccc2Cl)C(F)(F)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 C21H17ClF3N5O MW 447.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3N5O/c1-12-10-13(2)27-19(26-12)30-20(29-18(31)14-6-4-3-5-7-14)28-17-11-15(21(23,24)25)8-9-16(17)22/h3-11H,1-2H3,(H2,26,27,28,29,30,31)InChIKey
NCIMNZMGIASSGZ-UHFFFAOYSA-NSynonyms
356082-15-0(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)1PHENYL2AZAPROP2EN1ONE
(E)N(((2chloro5(trifluoromethyl)phenyl)amino)((46dimethylpyrimidin2yl)amino)methylene)benzamide
CC1=CC(=NC(=N1)NC(=NC(=O)C2=CC=CC=C2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)C
Cc1nc(NC(=NC(=O)c2ccccc2)Nc2cc(ccc2Cl)C(F)(F)F)nc(c1)C
InChI=1SC21H17ClF3N5Oc1121013(2)2719(2612)3020(2918(31)146435714)28171115(21(2324)25)8916(17)22h311H12H3(H2262728293031)
MFCD02722451
N((2CHLORO5(TRIFLUOROMETHYL)ANILINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)BENZAMIDE
N((E)((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)BENZAMIDE
N(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)BENZAMIDE
STK082531
ZINC000018136959
ZINC18136959
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