3-[[(5-methyl-1H-pyrazol-4-yl)-phenyl-amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(5-methyl-1H-pyrazol-4-yl)-phenyl-amino]methyl]benzenecarbonitrile Openeye Name: 3-[(N-(5-methyl-1H-pyrazol-4-yl)anilino)methyl]benzonitrile CAS Name: 3-[(N-(5-methyl-1H-pyrazol-4-yl)anilino)methyl]benzonitrile IUPAC Name: 3-[(N-(5-methyl-1H-pyrazol-4-yl)anilino)methyl]benzonitrile Traditional Name: 3-[(N-(5-methyl-1H-pyrazol-4-yl)anilino)methyl]benzonitrile Formula: C18H16N4 MolecularWeight: 288.34644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)N(CC2=CC=CC(=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1)N(CC2=CC=CC(=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H16N4/c1-14-18(12-20-21-14)22(17-8-3-2-4-9-17)13-16-7-5-6-15(10-16)11-19/h2-10,12H,13H2,1H3,(H,20,21)