1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide

Systemtic Name: 1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Openeye Name: 1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide CAS Name: 1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide IUPAC Name: 1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Traditional Name: 1-(2,5-dimethylphenyl)-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H28N2O4S2/c1-4-11-29(26,27)23-10-9-18-7-8-21(13-19(18)14-23)22-28(24,25)15-20-12-16(2)5-6-17(20)3/h5-8,12-13,22H,4,9-11,14-15H2,1-3H3