4-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[oxo-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C20H18N8O2 MolecularWeight: 402.40932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C20H18N8O2/c29-18-16-9-5-4-8-15(16)17(21-22-18)19(30)26-10-12-27(13-11-26)20-23-24-25-28(20)14-6-2-1-3-7-14/h1-9H,10-13H2,(H,22,29)