N6-(4-ethylphenyl)-N4-(2-fluorophenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-ethylphenyl)-N4-(2-fluorophenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-ethylphenyl)-N4-(2-fluorophenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-ethylphenyl)-N4-(2-fluorophenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-ethylphenyl)-4-N-(2-fluorophenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-ethylanilino)pyrimidin-4-yl]-(2-fluorophenyl)amine Formula: C18H18FN5 MolecularWeight: 323.367423

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC=C3F)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC=C3F)N

InChI

InChI=1S/C18H18FN5/c1-2-12-7-9-13(10-8-12)23-17-16(20)18(22-11-21-17)24-15-6-4-3-5-14(15)19/h3-11H,2,20H2,1H3,(H2,21,22,23,24)