4-oxidanylidene-3-pentyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-(2-phenyl-2-pyrrolidin-1-ylethyl)phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-(2-phenyl-2-pyrrolidino-ethyl)phthalazine-1-carboxamide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

InChI

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