N2-[4-(aminomethyl)phenyl]-N4-(3,5-dimethoxyphenyl)-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2-[4-(aminomethyl)phenyl]-N4-(3,5-dimethoxyphenyl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2-[4-(aminomethyl)phenyl]-N4-(3,5-dimethoxyphenyl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2-[4-(aminomethyl)phenyl]-N4-(3,5-dimethoxyphenyl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N-[4-(aminomethyl)phenyl]-4-N-(3,5-dimethoxyphenyl)-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-[4-(aminomethyl)anilino]-5-fluoro-pyrimidin-4-yl]-(3,5-dimethoxyphenyl)amine Formula: C19H20FN5O2 MolecularWeight: 369.392803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)CN)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)CN)OC

InChI

InChI=1S/C19H20FN5O2/c1-26-15-7-14(8-16(9-15)27-2)23-18-17(20)11-22-19(25-18)24-13-5-3-12(10-21)4-6-13/h3-9,11H,10,21H2,1-2H3,(H2,22,23,24,25)