(E)-2-(4-chlorophenyl)carbonyl-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-chlorophenyl)carbonyl-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-chlorobenzoyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-[(4-chlorophenyl)-oxomethyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(4-chlorobenzoyl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-chlorobenzoyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylonitrile Formula: C24H15ClN4O MolecularWeight: 410.8551

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C(C#N)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)/C=C(\C#N)/C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H15ClN4O/c25-21-10-8-17(9-11-21)24(30)19(14-26)13-20-16-29(22-6-2-1-3-7-22)28-23(20)18-5-4-12-27-15-18/h1-13,15-16H/b19-13+