N2-(1-benzofuran-5-yl)-N4-(4-tert-butylphenyl)-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2-(1-benzofuran-5-yl)-N4-(4-tert-butylphenyl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2-(benzofuran-5-yl)-N4-(4-tert-butylphenyl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2-(5-benzofuranyl)-N4-(4-tert-butylphenyl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N-(1-benzofuran-5-yl)-4-N-(4-tert-butylphenyl)-5-fluoropyrimidine-2,4-diamine Traditional Name: benzofuran-5-yl-[4-(4-tert-butylanilino)-5-fluoro-pyrimidin-2-yl]amine Formula: C22H21FN4O MolecularWeight: 376.426743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NC(=NC=C2F)NC3=CC4=C(C=C3)OC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NC(=NC=C2F)NC3=CC4=C(C=C3)OC=C4

InChI

InChI=1S/C22H21FN4O/c1-22(2,3)15-4-6-16(7-5-15)25-20-18(23)13-24-21(27-20)26-17-8-9-19-14(12-17)10-11-28-19/h4-13H,1-3H3,(H2,24,25,26,27)