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

Systemtic Name: 2-phenyl-4-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-phenyl-4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]methyl]-2-phenyl-1-phthalazinone IUPAC Name: 2-phenyl-4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-phenyl-4-[4-(1-phenyltetrazol-5-yl)piperazine-1-carbonyl]phthalazin-1-one Formula: C26H22N8O2 MolecularWeight: 478.50528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=NN(C(=O)C5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=NN(C(=O)C5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C26H22N8O2/c35-24-22-14-8-7-13-21(22)23(28-33(24)19-9-3-1-4-10-19)25(36)31-15-17-32(18-16-31)26-27-29-30-34(26)20-11-5-2-6-12-20/h1-14H,15-18H2