2-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)ethanenitrile

Systemtic Name: 2-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)ethanenitrile Openeye Name: 2-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile CAS Name: 2-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile IUPAC Name: 2-(1-benzyl-3,5-dimethylpyrazol-4-yl)-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile Traditional Name: 2-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-2-(3,5,5-trimethyl-2-pyrazolin-1-yl)acetonitrile Formula: C20H25N5 MolecularWeight: 335.446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C)C)C(C#N)C2=C(N(N=C2C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(C1)(C)C)C(C#N)C2=C(N(N=C2C)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H25N5/c1-14-11-20(4,5)25(22-14)18(12-21)19-15(2)23-24(16(19)3)13-17-9-7-6-8-10-17/h6-10,18H,11,13H2,1-5H3