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

Systemtic Name: 4-oxidanylidene-3-pentyl-N-[2-(pyrazol-1-ylmethyl)phenyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[2-(pyrazol-1-ylmethyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[2-(1-pyrazolylmethyl)phenyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-[2-(pyrazol-1-ylmethyl)phenyl]phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[2-(pyrazol-1-ylmethyl)phenyl]phthalazine-1-carboxamide Formula: C24H25N5O2 MolecularWeight: 415.4876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C24H25N5O2/c1-2-3-8-16-29-24(31)20-12-6-5-11-19(20)22(27-29)23(30)26-21-13-7-4-10-18(21)17-28-15-9-14-25-28/h4-7,9-15H,2-3,8,16-17H2,1H3,(H,26,30)