2-(4-chlorophenyl)-6-pyrazol-1-yl-2-(pyridin-3-ylmethyl)hexanenitrile

Systemtic Name: 2-(4-chlorophenyl)-6-pyrazol-1-yl-2-(pyridin-3-ylmethyl)hexanenitrile Openeye Name: 2-(4-chlorophenyl)-6-pyrazol-1-yl-2-(3-pyridylmethyl)hexanenitrile CAS Name: 2-(4-chlorophenyl)-6-(1-pyrazolyl)-2-(3-pyridinylmethyl)hexanenitrile IUPAC Name: 2-(4-chlorophenyl)-6-pyrazol-1-yl-2-(pyridin-3-ylmethyl)hexanenitrile Traditional Name: 2-(4-chlorophenyl)-6-pyrazol-1-yl-2-(3-pyridylmethyl)hexanenitrile Formula: C21H21ClN4 MolecularWeight: 364.87124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(CCCCN2C=CC=N2)(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)CC(CCCCN2C=CC=N2)(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN4/c22-20-8-6-19(7-9-20)21(17-23,15-18-5-3-11-24-16-18)10-1-2-13-26-14-4-12-25-26/h3-9,11-12,14,16H,1-2,10,13,15H2