4-[4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]ethyl]piperazin-1-yl]-2H-phthalazin-1-one

Systemtic Name: 4-[4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]ethyl]piperazin-1-yl]-2H-phthalazin-1-one Openeye Name: 4-[4-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]piperazin-1-yl]-2H-phthalazin-1-one CAS Name: 4-[4-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]-1-piperazinyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]piperazin-1-yl]-2H-phthalazin-1-one Traditional Name: 4-[4-[2-[(4-keto-1H-quinazolin-2-yl)amino]ethyl]piperazino]-2H-phthalazin-1-one Formula: C22H23N7O2 MolecularWeight: 417.46372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC2=NC(=O)C3=CC=CC=C3N2)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCNC2=NC(=O)C3=CC=CC=C3N2)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C22H23N7O2/c30-20-17-7-3-4-8-18(17)24-22(25-20)23-9-10-28-11-13-29(14-12-28)19-15-5-1-2-6-16(15)21(31)27-26-19/h1-8H,9-14H2,(H,27,31)(H2,23,24,25,30)