2-[4-[[6-(3-cyanopropoxy)pyridin-3-yl]methylamino]phenyl]-5-pyridin-3-yl-pyrazole-3-carbonitrile

Systemtic Name: 2-[4-[[6-(3-cyanopropoxy)pyridin-3-yl]methylamino]phenyl]-5-pyridin-3-yl-pyrazole-3-carbonitrile Openeye Name: 2-[4-[[6-(3-cyanopropoxy)-3-pyridyl]methylamino]phenyl]-5-(3-pyridyl)pyrazole-3-carbonitrile CAS Name: 2-[4-[[6-(3-cyanopropoxy)-3-pyridinyl]methylamino]phenyl]-5-(3-pyridinyl)-3-pyrazolecarbonitrile IUPAC Name: 2-[4-[[6-(3-cyanopropoxy)pyridin-3-yl]methylamino]phenyl]-5-pyridin-3-ylpyrazole-3-carbonitrile Traditional Name: 2-[4-[[6-(3-cyanopropoxy)-3-pyridyl]methylamino]phenyl]-5-(3-pyridyl)pyrazole-3-carbonitrile Formula: C25H21N7O MolecularWeight: 435.48054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=C2)C#N)C3=CC=C(C=C3)NCC4=CN=C(C=C4)OCCCC#N

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=C2)C#N)C3=CC=C(C=C3)NCC4=CN=C(C=C4)OCCCC#N

InChI

InChI=1S/C25H21N7O/c26-11-1-2-13-33-25-10-5-19(17-30-25)16-29-21-6-8-22(9-7-21)32-23(15-27)14-24(31-32)20-4-3-12-28-18-20/h3-10,12,14,17-18,29H,1-2,13,16H2