NCS
China New Chemical Substance Search
6-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-N4-[(4-chlorophenyl)methyl]pyrimidine-2,4-diamine
CAS Number: 2085690-19-1
IUPAC name: 4-N-[(4-chlorophenyl)methyl]-6-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrimidine-2,4-diamine
Molecular formula: C21H20Cl2F3N7
Molecular weight: 498.3
InChI: InChI=1S/C21H20Cl2F3N7/c22-15-3-1-13(2-4-15)11-28-17-10-18(31-20(27)30-17)32-5-7-33(8-6-32)19-16(23)9-14(12-29-19)21(24,25)26/h1-4,9-10,12H,5-8,11H2,(H3,27,28,30,31)
InChIKey: CIPJKJNLXMXFHH-UHFFFAOYSA-N
SMILES: C1CN(CCN1C2=NC(=NC(=C2)NCC3=CC=C(C=C3)Cl)N)C4=C(C=C(C=N4)C(F)(F)F)Cl
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