3-[[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzonitrile CAS Name: 3-[[5-(2-amino-4-pyrimidinyl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzonitrile IUPAC Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzonitrile Traditional Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]benzonitrile Formula: C21H15FN6 MolecularWeight: 370.382403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC2=NC(=C(N2)C3=NC(=NC=C3)N)C4=CC=C(C=C4)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CC2=NC(=C(N2)C3=NC(=NC=C3)N)C4=CC=C(C=C4)F)C#N

InChI

InChI=1S/C21H15FN6/c22-16-6-4-15(5-7-16)19-20(17-8-9-25-21(24)26-17)28-18(27-19)11-13-2-1-3-14(10-13)12-23/h1-10H,11H2,(H,27,28)(H2,24,25,26)