4-(3-azanyl-1-imidazol-1-yl-propyl)benzenecarbonitrile

Systemtic Name: 4-(3-azanyl-1-imidazol-1-yl-propyl)benzenecarbonitrile Openeye Name: 4-(3-amino-1-imidazol-1-yl-propyl)benzonitrile CAS Name: 4-[3-amino-1-(1-imidazolyl)propyl]benzonitrile IUPAC Name: 4-(3-amino-1-imidazol-1-ylpropyl)benzonitrile Traditional Name: 4-(3-amino-1-imidazol-1-yl-propyl)benzonitrile Formula: C13H14N4 MolecularWeight: 226.27706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(CCN)N2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1C#N)C(CCN)N2C=CN=C2

InChI

InChI=1S/C13H14N4/c14-6-5-13(17-8-7-16-10-17)12-3-1-11(9-15)2-4-12/h1-4,7-8,10,13H,5-6,14H2