N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(3-methylbutyl)benzenesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(3-methylbutyl)benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-isopentyl-benzenesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(3-methylbutyl)benzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(3-methylbutyl)benzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-isoamyl-benzenesulfonamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(CC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-18(2)12-15-24(28(26,27)21-10-4-3-5-11-21)17-22(25)23-14-13-19-8-6-7-9-20(19)16-23/h3-11,18H,12-17H2,1-2H3