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

Systemtic Name: N2,N4-bis[3-(aminomethyl)phenyl]-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis[3-(aminomethyl)phenyl]-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis[3-(aminomethyl)phenyl]-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis[3-(aminomethyl)phenyl]-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-[3-(aminomethyl)anilino]-5-fluoro-pyrimidin-4-yl]-[3-(aminomethyl)phenyl]amine Formula: C18H19FN6 MolecularWeight: 338.382063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC=C2F)NC3=CC=CC(=C3)CN)CN

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC=C2F)NC3=CC=CC(=C3)CN)CN

InChI

InChI=1S/C18H19FN6/c19-16-11-22-18(24-15-6-2-4-13(8-15)10-21)25-17(16)23-14-5-1-3-12(7-14)9-20/h1-8,11H,9-10,20-21H2,(H2,22,23,24,25)