4-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: 4-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: 4-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: 4-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: 4-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: 4-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C28H21N3O2S MolecularWeight: 463.55024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C5=NC6=CC=CC=C6C(=C5C1)C(=O)O

Isomeric SMILES

C1CC(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C5=NC6=CC=CC=C6C(=C5C1)C(=O)O

InChI

InChI=1S/C28H21N3O2S/c32-28(33)25-21-11-4-5-13-23(21)29-26-18(8-6-12-22(25)26)16-19-17-31(20-9-2-1-3-10-20)30-27(19)24-14-7-15-34-24/h1-5,7,9-11,13-17H,6,8,12H2,(H,32,33)