2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylamino]-6-fluoro-benzonitrile CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-6-fluorobenzonitrile Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylamino]-6-fluoro-benzonitrile Formula: C13H12FN3O MolecularWeight: 245.252283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CNC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CC1=C(C(=NO1)C)CNC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C13H12FN3O/c1-8-11(9(2)18-17-8)7-16-13-5-3-4-12(14)10(13)6-15/h3-5,16H,7H2,1-2H3