4-[4-(phenylmethyl)piperidin-1-yl]-N-(2-piperidin-1-ylethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(phenylmethyl)piperidin-1-yl]-N-(2-piperidin-1-ylethyl)phthalazine-1-carboxamide Openeye Name: 4-(4-benzyl-1-piperidyl)-N-[2-(1-piperidyl)ethyl]phthalazine-1-carboxamide CAS Name: 4-[4-(phenylmethyl)-1-piperidinyl]-N-[2-(1-piperidinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-N-(2-piperidin-1-ylethyl)phthalazine-1-carboxamide Traditional Name: 4-(4-benzylpiperidino)-N-(2-piperidinoethyl)phthalazine-1-carboxamide Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H35N5O/c34-28(29-15-20-32-16-7-2-8-17-32)26-24-11-5-6-12-25(24)27(31-30-26)33-18-13-23(14-19-33)21-22-9-3-1-4-10-22/h1,3-6,9-12,23H,2,7-8,13-21H2,(H,29,34)