1-[2-[4-(pyridin-2-ylamino)phenoxy]pyridin-3-yl]piperidine-4-carbonitrile

Systemtic Name: 1-[2-[4-(pyridin-2-ylamino)phenoxy]pyridin-3-yl]piperidine-4-carbonitrile Openeye Name: 1-[2-[4-(2-pyridylamino)phenoxy]-3-pyridyl]piperidine-4-carbonitrile CAS Name: 1-[2-[4-(2-pyridinylamino)phenoxy]-3-pyridinyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[4-(pyridin-2-ylamino)phenoxy]pyridin-3-yl]piperidine-4-carbonitrile Traditional Name: 1-[2-[4-(2-pyridylamino)phenoxy]-3-pyridyl]isonipecotonitrile Formula: C22H21N5O MolecularWeight: 371.43504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)C2=C(N=CC=C2)OC3=CC=C(C=C3)NC4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1C#N)C2=C(N=CC=C2)OC3=CC=C(C=C3)NC4=CC=CC=N4

InChI

InChI=1S/C22H21N5O/c23-16-17-10-14-27(15-11-17)20-4-3-13-25-22(20)28-19-8-6-18(7-9-19)26-21-5-1-2-12-24-21/h1-9,12-13,17H,10-11,14-15H2,(H,24,26)