2-[3-oxidanylidene-6-(phenylmethyl)-2H-1,2,4-triazin-5-yl]phthalazin-1-one

Systemtic Name: 2-[3-oxidanylidene-6-(phenylmethyl)-2H-1,2,4-triazin-5-yl]phthalazin-1-one Openeye Name: 2-(6-benzyl-3-oxo-2H-1,2,4-triazin-5-yl)phthalazin-1-one CAS Name: 2-[3-oxo-6-(phenylmethyl)-2H-1,2,4-triazin-5-yl]-1-phthalazinone IUPAC Name: 2-(6-benzyl-3-oxo-2H-1,2,4-triazin-5-yl)phthalazin-1-one Traditional Name: 2-(6-benzyl-3-keto-2H-1,2,4-triazin-5-yl)phthalazin-1-one Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=O)N=C2N3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=O)N=C2N3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C18H13N5O2/c24-17-14-9-5-4-8-13(14)11-19-23(17)16-15(21-22-18(25)20-16)10-12-6-2-1-3-7-12/h1-9,11H,10H2,(H,20,22,25)