N-[2-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)ethyl]benzenesulfonamide

Systemtic Name: N-[2-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)ethyl]benzenesulfonamide Openeye Name: N-[2-[1-oxo-4-(3-pyridyl)phthalazin-2-yl]ethyl]benzenesulfonamide CAS Name: N-[2-[1-oxo-4-(3-pyridinyl)-2-phthalazinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(1-oxo-4-pyridin-3-ylphthalazin-2-yl)ethyl]benzenesulfonamide Traditional Name: N-[2-[1-keto-4-(3-pyridyl)phthalazin-2-yl]ethyl]benzenesulfonamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCN2C(=O)C3=CC=CC=C3C(=N2)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCN2C(=O)C3=CC=CC=C3C(=N2)C4=CN=CC=C4

InChI

InChI=1S/C21H18N4O3S/c26-21-19-11-5-4-10-18(19)20(16-7-6-12-22-15-16)24-25(21)14-13-23-29(27,28)17-8-2-1-3-9-17/h1-12,15,23H,13-14H2