(4E)-2-(3-chlorophenyl)-5-methyl-4-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]pyrazol-3-one Openeye Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]pyrazol-3-one CAS Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]pyrazol-3-one Traditional Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]-2-pyrazolin-3-one Formula: C24H17ClN4OS MolecularWeight: 444.93598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H17ClN4OS/c1-16-21(24(30)29(26-16)20-10-5-7-18(25)14-20)13-17-15-28(19-8-3-2-4-9-19)27-23(17)22-11-6-12-31-22/h2-15H,1H3/b21-13+