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

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[4-(phenylmethyl)piperidin-1-yl]phthalazine-1-carboxamide Openeye Name: 4-(4-benzyl-1-piperidyl)-N-[3-(dimethylamino)propyl]phthalazine-1-carboxamide CAS Name: N-[3-(dimethylamino)propyl]-4-[4-(phenylmethyl)-1-piperidinyl]-1-phthalazinecarboxamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-N-[3-(dimethylamino)propyl]phthalazine-1-carboxamide Traditional Name: 4-(4-benzylpiperidino)-N-[3-(dimethylamino)propyl]phthalazine-1-carboxamide Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN(C)CCCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H33N5O/c1-30(2)16-8-15-27-26(32)24-22-11-6-7-12-23(22)25(29-28-24)31-17-13-21(14-18-31)19-20-9-4-3-5-10-20/h3-7,9-12,21H,8,13-19H2,1-2H3,(H,27,32)