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

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-4-propyl-benzenesulfonamide Openeye Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-propyl-benzenesulfonamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-propylbenzenesulfonamide IUPAC Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-propylbenzenesulfonamide Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-4-propyl-benzenesulfonamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H24N4O3S/c1-2-6-15-9-11-16(12-10-15)28(26,27)22-14-5-13-21-19-17-7-3-4-8-18(17)20(25)24-23-19/h3-4,7-12,22H,2,5-6,13-14H2,1H3,(H,21,23)(H,24,25)