4-[1-azanyl-1-[3-(2-cyclopropylethynyl)imidazol-4-yl]ethyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[1-azanyl-1-[3-(2-cyclopropylethynyl)imidazol-4-yl]ethyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[1-amino-1-[3-(2-cyclopropylethynyl)imidazol-4-yl]ethyl]-2-fluoro-benzonitrile CAS Name: 4-[1-amino-1-[3-(2-cyclopropylethynyl)-4-imidazolyl]ethyl]-2-fluorobenzonitrile IUPAC Name: 4-[1-amino-1-[3-(2-cyclopropylethynyl)imidazol-4-yl]ethyl]-2-fluorobenzonitrile Traditional Name: 4-[1-amino-1-[3-(2-cyclopropylethynyl)imidazol-4-yl]ethyl]-2-fluoro-benzonitrile Formula: C17H15FN4 MolecularWeight: 294.326203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C#CC3CC3)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C#CC3CC3)N

InChI

InChI=1S/C17H15FN4/c1-17(20,14-5-4-13(9-19)15(18)8-14)16-10-21-11-22(16)7-6-12-2-3-12/h4-5,8,10-12H,2-3,20H2,1H3