N2-[4-[(3-chloranyl-4-fluoranyl-phenyl)methylamino]cyclohexyl]-N4,N4,5-trimethyl-pyridine-2,4-diamine

Systemtic Name: N2-[4-[(3-chloranyl-4-fluoranyl-phenyl)methylamino]cyclohexyl]-N4,N4,5-trimethyl-pyridine-2,4-diamine Openeye Name: N2-[4-[(3-chloro-4-fluoro-phenyl)methylamino]cyclohexyl]-N4,N4,5-trimethyl-pyridine-2,4-diamine CAS Name: N2-[4-[(3-chloro-4-fluorophenyl)methylamino]cyclohexyl]-N4,N4,5-trimethylpyridine-2,4-diamine IUPAC Name: 2-N-[4-[(3-chloro-4-fluorophenyl)methylamino]cyclohexyl]-4-N,4-N,5-trimethylpyridine-2,4-diamine Traditional Name: [2-[[4-[(3-chloro-4-fluoro-benzyl)amino]cyclohexyl]amino]-5-methyl-4-pyridyl]-dimethyl-amine Formula: C21H28ClFN4 MolecularWeight: 390.925223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1N(C)C)NC2CCC(CC2)NCC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CN=C(C=C1N(C)C)NC2CCC(CC2)NCC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H28ClFN4/c1-14-12-25-21(11-20(14)27(2)3)26-17-7-5-16(6-8-17)24-13-15-4-9-19(23)18(22)10-15/h4,9-12,16-17,24H,5-8,13H2,1-3H3,(H,25,26)