3-[4-(4-fluorophenyl)-5-[2-(methylamino)pyrimidin-4-yl]imidazol-1-yl]propanenitrile

Systemtic Name: 3-[4-(4-fluorophenyl)-5-[2-(methylamino)pyrimidin-4-yl]imidazol-1-yl]propanenitrile Openeye Name: 3-[4-(4-fluorophenyl)-5-[2-(methylamino)pyrimidin-4-yl]imidazol-1-yl]propanenitrile CAS Name: 3-[4-(4-fluorophenyl)-5-[2-(methylamino)-4-pyrimidinyl]-1-imidazolyl]propanenitrile IUPAC Name: 3-[4-(4-fluorophenyl)-5-[2-(methylamino)pyrimidin-4-yl]imidazol-1-yl]propanenitrile Traditional Name: 3-[4-(4-fluorophenyl)-5-[2-(methylamino)pyrimidin-4-yl]imidazol-1-yl]propionitrile Formula: C17H15FN6 MolecularWeight: 322.339603

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC(=N1)C2=C(N=CN2CCC#N)C3=CC=C(C=C3)F

Isomeric SMILES

CNC1=NC=CC(=N1)C2=C(N=CN2CCC#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN6/c1-20-17-21-9-7-14(23-17)16-15(12-3-5-13(18)6-4-12)22-11-24(16)10-2-8-19/h3-7,9,11H,2,10H2,1H3,(H,20,21,23)