5-azanyl-3-(3-azanylpropyl)-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-(3-azanylpropyl)-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-(3-aminopropyl)-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-(3-aminopropyl)-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-(3-aminopropyl)-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-(3-aminopropyl)-1-phenyl-pyrazole-4-carbonitrile Formula: C13H15N5 MolecularWeight: 241.2917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCN)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCN)C#N)N

InChI

InChI=1S/C13H15N5/c14-8-4-7-12-11(9-15)13(16)18(17-12)10-5-2-1-3-6-10/h1-3,5-6H,4,7-8,14,16H2