N-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methoxy-pyrimidin-4-amine

Systemtic Name: N-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methoxy-pyrimidin-4-amine Openeye Name: N-[(4-chloro-2-fluoro-phenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methoxy-pyrimidin-4-amine CAS Name: N-[(4-chloro-2-fluorophenyl)methyl]-2-[4-(4-ethyl-1-piperazinyl)phenyl]-5-methoxy-4-pyrimidinamine IUPAC Name: N-[(4-chloro-2-fluorophenyl)methyl]-2-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methoxypyrimidin-4-amine Traditional Name: (4-chloro-2-fluoro-benzyl)-[2-[4-(4-ethylpiperazino)phenyl]-5-methoxy-pyrimidin-4-yl]amine Formula: C24H27ClFN5O MolecularWeight: 455.955483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClFN5O/c1-3-30-10-12-31(13-11-30)20-8-5-17(6-9-20)23-28-16-22(32-2)24(29-23)27-15-18-4-7-19(25)14-21(18)26/h4-9,14,16H,3,10-13,15H2,1-2H3,(H,27,28,29)