4-oxidanylidene-3-(phenylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[3-(4-phenylpiperazino)propyl]phthalazine-1-carboxamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2/c35-28(30-16-9-17-32-18-20-33(21-19-32)24-12-5-2-6-13-24)27-25-14-7-8-15-26(25)29(36)34(31-27)22-23-10-3-1-4-11-23/h1-8,10-15H,9,16-22H2,(H,30,35)