4-(phenoxymethyl)-N-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]benzamide

Systemtic Name: 4-(phenoxymethyl)-N-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-(phenoxymethyl)-N-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-(phenoxymethyl)-N-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylideneamino]benzamide IUPAC Name: 4-(phenoxymethyl)-N-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-(phenoxymethyl)-N-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]benzamide Formula: C28H22N4O2S MolecularWeight: 478.56488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=NNC(=O)C4=CC=C(C=C4)COC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=NNC(=O)C4=CC=C(C=C4)COC5=CC=CC=C5

InChI

InChI=1S/C28H22N4O2S/c33-28(22-15-13-21(14-16-22)20-34-25-10-5-2-6-11-25)30-29-18-23-19-32(24-8-3-1-4-9-24)31-27(23)26-12-7-17-35-26/h1-19H,20H2,(H,30,33)