N-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide

Systemtic Name: N-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide Openeye Name: N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide CAS Name: N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide IUPAC Name: N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide Traditional Name: N-[4-[(4-keto-3H-phthalazin-1-yl)amino]butyl]benzenesulfonamide Formula: C18H20N4O3S MolecularWeight: 372.4414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H20N4O3S/c23-18-16-11-5-4-10-15(16)17(21-22-18)19-12-6-7-13-20-26(24,25)14-8-2-1-3-9-14/h1-5,8-11,20H,6-7,12-13H2,(H,19,21)(H,22,23)