3-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]quinazolin-4-one

Systemtic Name: 3-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]quinazolin-4-one Openeye Name: 3-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[(5-phenyltetrazol-2-yl)methyl]quinazolin-4-one CAS Name: 3-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[(5-phenyl-2-tetrazolyl)methyl]-4-quinazolinone IUPAC Name: 3-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[(5-phenyltetrazol-2-yl)methyl]quinazolin-4-one Traditional Name: 3-[(4-keto-1H-quinazolin-2-yl)methyl]-2-[(5-phenyltetrazol-2-yl)methyl]quinazolin-4-one Formula: C25H18N8O2 MolecularWeight: 462.46282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC3=NC4=CC=CC=C4C(=O)N3CC5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC3=NC4=CC=CC=C4C(=O)N3CC5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C25H18N8O2/c34-24-17-10-4-6-12-19(17)26-21(28-24)14-32-22(27-20-13-7-5-11-18(20)25(32)35)15-33-30-23(29-31-33)16-8-2-1-3-9-16/h1-13H,14-15H2,(H,26,28,34)