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

Systemtic Name: 4-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-3H-phthalazine-1-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=NNC(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=NNC(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O2/c29-22-20-10-5-4-9-19(20)21(25-26-22)23(30)24-11-6-12-27-13-15-28(16-14-27)17-18-7-2-1-3-8-18/h1-5,7-10H,6,11-17H2,(H,24,30)(H,26,29)