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

Systemtic Name: 3-bromanyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[(3,5-dimethylisoxazol-4-yl)methylamino]benzonitrile CAS Name: 3-bromo-4-[(3,5-dimethyl-4-isoxazolyl)methylamino]benzonitrile IUPAC Name: 3-bromo-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]benzonitrile Traditional Name: 3-bromo-4-[(3,5-dimethylisoxazol-4-yl)methylamino]benzonitrile Formula: C13H12BrN3O MolecularWeight: 306.15788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CNC2=C(C=C(C=C2)C#N)Br

Isomeric SMILES

CC1=C(C(=NO1)C)CNC2=C(C=C(C=C2)C#N)Br

InChI

InChI=1S/C13H12BrN3O/c1-8-11(9(2)18-17-8)7-16-13-4-3-10(6-15)5-12(13)14/h3-5,16H,7H2,1-2H3