3-[1,3-bis(oxidanylidene)-4-(phenylazanylmethylidene)isoquinolin-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4-(phenylazanylmethylidene)isoquinolin-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[4-(anilinomethylene)-1,3-dioxo-2-isoquinolyl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[4-(anilinomethylidene)-1,3-dioxo-2-isoquinolinyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-(anilinomethylidene)-1,3-dioxoisoquinolin-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[4-(anilinomethylene)-1,3-diketo-2-isoquinolyl]-N,N-diethyl-benzenesulfonamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=C4)C2=O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=C4)C2=O

InChI

InChI=1S/C26H25N3O4S/c1-3-28(4-2)34(32,33)21-14-10-13-20(17-21)29-25(30)23-16-9-8-15-22(23)24(26(29)31)18-27-19-11-6-5-7-12-19/h5-18,27H,3-4H2,1-2H3