(Z)-3-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (Z)-3-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-[1-(2-chlorobenzyl)pyrazol-4-yl]-2-(2-pyridyl)acrylonitrile Formula: C18H13ClN4 MolecularWeight: 320.77562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)C=C(C#N)C3=CC=CC=N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)/C=C(\C#N)/C3=CC=CC=N3)Cl

InChI

InChI=1S/C18H13ClN4/c19-17-6-2-1-5-15(17)13-23-12-14(11-22-23)9-16(10-20)18-7-3-4-8-21-18/h1-9,11-12H,13H2/b16-9+