N',N'-diethyl-N-[5-(4-fluorophenyl)-4-pyridin-4-yl-pyrimidin-2-yl]ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-[5-(4-fluorophenyl)-4-pyridin-4-yl-pyrimidin-2-yl]ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-[5-(4-fluorophenyl)-4-(4-pyridyl)pyrimidin-2-yl]ethane-1,2-diamine CAS Name: N',N'-diethyl-N-[5-(4-fluorophenyl)-4-pyridin-4-yl-2-pyrimidinyl]ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-[5-(4-fluorophenyl)-4-pyridin-4-ylpyrimidin-2-yl]ethane-1,2-diamine Traditional Name: diethyl-[2-[[5-(4-fluorophenyl)-4-(4-pyridyl)pyrimidin-2-yl]amino]ethyl]amine Formula: C21H24FN5 MolecularWeight: 365.447163

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC=C(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)CCNC1=NC=C(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN5/c1-3-27(4-2)14-13-24-21-25-15-19(16-5-7-18(22)8-6-16)20(26-21)17-9-11-23-12-10-17/h5-12,15H,3-4,13-14H2,1-2H3,(H,24,25,26)