N-[2-[3-(dimethylaminomethyl)-6-methoxy-1-oxidanylidene-4-phenyl-isoquinolin-2-yl]ethyl]benzenesulfonamide

Systemtic Name: N-[2-[3-(dimethylaminomethyl)-6-methoxy-1-oxidanylidene-4-phenyl-isoquinolin-2-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-[3-(dimethylaminomethyl)-6-methoxy-1-oxo-4-phenyl-2-isoquinolyl]ethyl]benzenesulfonamide CAS Name: N-[2-[3-(dimethylaminomethyl)-6-methoxy-1-oxo-4-phenyl-2-isoquinolinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-[3-(dimethylaminomethyl)-6-methoxy-1-oxo-4-phenylisoquinolin-2-yl]ethyl]benzenesulfonamide Traditional Name: N-[2-[3-(dimethylaminomethyl)-1-keto-6-methoxy-4-phenyl-2-isoquinolyl]ethyl]benzenesulfonamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C2=C(C=CC(=C2)OC)C(=O)N1CCNS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)CC1=C(C2=C(C=CC(=C2)OC)C(=O)N1CCNS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S/c1-29(2)19-25-26(20-10-6-4-7-11-20)24-18-21(34-3)14-15-23(24)27(31)30(25)17-16-28-35(32,33)22-12-8-5-9-13-22/h4-15,18,28H,16-17,19H2,1-3H3