N-(3-morpholin-4-ylpropyl)-4-[4-(phenylmethyl)piperidin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-4-[4-(phenylmethyl)piperidin-1-yl]phthalazine-1-carboxamide Openeye Name: 4-(4-benzyl-1-piperidyl)-N-(3-morpholinopropyl)phthalazine-1-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-4-[4-(phenylmethyl)-1-piperidinyl]-1-phthalazinecarboxamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)phthalazine-1-carboxamide Traditional Name: 4-(4-benzylpiperidino)-N-(3-morpholinopropyl)phthalazine-1-carboxamide Formula: C28H35N5O2 MolecularWeight: 473.6098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCN5CCOCC5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C28H35N5O2/c34-28(29-13-6-14-32-17-19-35-20-18-32)26-24-9-4-5-10-25(24)27(31-30-26)33-15-11-23(12-16-33)21-22-7-2-1-3-8-22/h1-5,7-10,23H,6,11-21H2,(H,29,34)