4-oxidanylidene-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-phenyl-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[2-(pyrazol-1-ylmethyl)benzyl]phthalazine-1-carboxamide Formula: C26H21N5O2 MolecularWeight: 435.47724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CC=C4CN5C=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CC=C4CN5C=CC=N5

InChI

InChI=1S/C26H21N5O2/c32-25(27-17-19-9-4-5-10-20(19)18-30-16-8-15-28-30)24-22-13-6-7-14-23(22)26(33)31(29-24)21-11-2-1-3-12-21/h1-16H,17-18H2,(H,27,32)