3-[(4-azanyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(4-azanyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(4-amino-3,5-dimethyl-pyrazol-1-yl)methyl]benzonitrile CAS Name: 3-[(4-amino-3,5-dimethyl-1-pyrazolyl)methyl]benzonitrile IUPAC Name: 3-[(4-amino-3,5-dimethylpyrazol-1-yl)methyl]benzonitrile Traditional Name: 3-[(4-amino-3,5-dimethyl-pyrazol-1-yl)methyl]benzonitrile Formula: C13H14N4 MolecularWeight: 226.27706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C#N)C)N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C#N)C)N

InChI

InChI=1S/C13H14N4/c1-9-13(15)10(2)17(16-9)8-12-5-3-4-11(6-12)7-14/h3-6H,8,15H2,1-2H3