N-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-6-methyl-pyrimidin-4-amine

Systemtic Name: N-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-6-methyl-pyrimidin-4-amine Openeye Name: N-[(4-chloro-2-fluoro-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-6-methyl-pyrimidin-4-amine CAS Name: N-[(4-chloro-2-fluorophenyl)methyl]-2-[4-(4-ethyl-1-piperazinyl)phenyl]-6-methyl-4-pyrimidinamine IUPAC Name: N-[(4-chloro-2-fluorophenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-6-methylpyrimidin-4-amine Traditional Name: (4-chloro-2-fluoro-benzyl)-[2-[4-(4-ethylpiperazino)phenyl]-6-methyl-pyrimidin-4-yl]amine Formula: C24H27ClFN5 MolecularWeight: 439.956083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)C3=NC(=CC(=N3)NCC4=C(C=C(C=C4)Cl)F)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)C3=NC(=CC(=N3)NCC4=C(C=C(C=C4)Cl)F)C

InChI

InChI=1S/C24H27ClFN5/c1-3-30-10-12-31(13-11-30)21-8-5-18(6-9-21)24-28-17(2)14-23(29-24)27-16-19-4-7-20(25)15-22(19)26/h4-9,14-15H,3,10-13,16H2,1-2H3,(H,27,28,29)