N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-[4-(phenylmethyl)piperidin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-[4-(phenylmethyl)piperidin-1-yl]phthalazine-1-carboxamide Openeye Name: 4-(4-benzyl-1-piperidyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]phthalazine-1-carboxamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-[4-(phenylmethyl)-1-piperidinyl]-1-phthalazinecarboxamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]phthalazine-1-carboxamide Traditional Name: 4-(4-benzylpiperidino)-N-[3-(2-ketopyrrolidino)propyl]phthalazine-1-carboxamide Formula: C28H33N5O2 MolecularWeight: 471.59392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H33N5O2/c34-25-12-6-16-32(25)17-7-15-29-28(35)26-23-10-4-5-11-24(23)27(31-30-26)33-18-13-22(14-19-33)20-21-8-2-1-3-9-21/h1-5,8-11,22H,6-7,12-20H2,(H,29,35)