N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[4-(dimethylamino)cyclohexyl]pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-[4-(dimethylamino)cyclohexyl]pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-[4-(dimethylamino)cyclohexyl]pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-[4-(dimethylamino)cyclohexyl]pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-[4-(dimethylamino)cyclohexyl]pyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: [4-[[4-(3-chloro-4-fluoro-anilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexyl]-dimethyl-amine Formula: C20H23ClFN7 MolecularWeight: 415.894923

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CN(C)C1CCC(CC1)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H23ClFN7/c1-29(2)14-6-3-12(4-7-14)27-20-23-10-17-18(28-20)19(25-11-24-17)26-13-5-8-16(22)15(21)9-13/h5,8-12,14H,3-4,6-7H2,1-2H3,(H,23,27,28)(H,24,25,26)