4-oxidanylidene-3-(phenylmethyl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(6-pyrrolidino-3-pyridyl)methyl]phthalazine-1-carboxamide Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H25N5O2/c32-25(28-17-20-12-13-23(27-16-20)30-14-6-7-15-30)24-21-10-4-5-11-22(21)26(33)31(29-24)18-19-8-2-1-3-9-19/h1-5,8-13,16H,6-7,14-15,17-18H2,(H,28,32)