1-phenyl-5-(pyridin-4-ylmethylamino)pyrazole-4-carbonitrile

Systemtic Name: 1-phenyl-5-(pyridin-4-ylmethylamino)pyrazole-4-carbonitrile Openeye Name: 1-phenyl-5-(4-pyridylmethylamino)pyrazole-4-carbonitrile CAS Name: 1-phenyl-5-(pyridin-4-ylmethylamino)-4-pyrazolecarbonitrile IUPAC Name: 1-phenyl-5-(pyridin-4-ylmethylamino)pyrazole-4-carbonitrile Traditional Name: 1-phenyl-5-(4-pyridylmethylamino)pyrazole-4-carbonitrile Formula: C16H13N5 MolecularWeight: 275.30792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NCC3=CC=NC=C3

InChI

InChI=1S/C16H13N5/c17-10-14-12-20-21(15-4-2-1-3-5-15)16(14)19-11-13-6-8-18-9-7-13/h1-9,12,19H,11H2