N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-propyl-benzenesulfonamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propyl-benzenesulfonamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propylbenzenesulfonamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propylbenzenesulfonamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propyl-benzenesulfonamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H26N2O3S/c1-2-6-19-9-13-24(14-10-19)31(29,30)26-23-12-11-20-15-16-27(18-22(20)17-23)25(28)21-7-4-3-5-8-21/h3-5,7-14,17,26H,2,6,15-16,18H2,1H3