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

Systemtic Name: 4-oxidanylidene-3-pentyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[2-(pyrrolidinomethyl)benzyl]phthalazine-1-carboxamide Formula: C26H32N4O2 MolecularWeight: 432.55788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3CN4CCCC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3CN4CCCC4

InChI

InChI=1S/C26H32N4O2/c1-2-3-8-17-30-26(32)23-14-7-6-13-22(23)24(28-30)25(31)27-18-20-11-4-5-12-21(20)19-29-15-9-10-16-29/h4-7,11-14H,2-3,8-10,15-19H2,1H3,(H,27,31)