4-oxidanylidene-3-(phenylmethyl)-N-(3-pyrazin-2-yloxyphenyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-(3-pyrazin-2-yloxyphenyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-(3-pyrazin-2-yloxyphenyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[3-(2-pyrazinyloxy)phenyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(3-pyrazin-2-yloxyphenyl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(3-pyrazin-2-yloxyphenyl)phthalazine-1-carboxamide Formula: C26H19N5O3 MolecularWeight: 449.46076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=CC=C4)OC5=NC=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=CC=C4)OC5=NC=CN=C5

InChI

InChI=1S/C26H19N5O3/c32-25(29-19-9-6-10-20(15-19)34-23-16-27-13-14-28-23)24-21-11-4-5-12-22(21)26(33)31(30-24)17-18-7-2-1-3-8-18/h1-16H,17H2,(H,29,32)