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

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4-(propylaminomethylidene)isoquinolin-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[1,3-dioxo-4-(propylaminomethylene)-2-isoquinolyl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[1,3-dioxo-4-(propylaminomethylidene)-2-isoquinolinyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[1,3-dioxo-4-(propylaminomethylidene)isoquinolin-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[1,3-diketo-4-(propylaminomethylene)-2-isoquinolyl]-N,N-diethyl-benzenesulfonamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C23H27N3O4S/c1-4-14-24-16-21-19-12-7-8-13-20(19)22(27)26(23(21)28)17-10-9-11-18(15-17)31(29,30)25(5-2)6-3/h7-13,15-16,24H,4-6,14H2,1-3H3