3-azanyl-1-(3-phenylpropyl)pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-1-(3-phenylpropyl)pyrazole-4-carbonitrile Openeye Name: 3-amino-1-(3-phenylpropyl)pyrazole-4-carbonitrile CAS Name: 3-amino-1-(3-phenylpropyl)-4-pyrazolecarbonitrile IUPAC Name: 3-amino-1-(3-phenylpropyl)pyrazole-4-carbonitrile Traditional Name: 3-amino-1-(3-phenylpropyl)pyrazole-4-carbonitrile Formula: C13H14N4 MolecularWeight: 226.27706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C=C(C(=N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C=C(C(=N2)N)C#N

InChI

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