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

Systemtic Name: 1-(2,5-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide Openeye Name: 1-(2,5-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide CAS Name: 1-(2,5-dimethylphenyl)-N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide IUPAC Name: 1-(2,5-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide Traditional Name: 1-(2,5-dimethylphenyl)-N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2

InChI

InChI=1S/C22H28N2O3S/c1-15(2)22(25)24-10-9-18-7-8-21(12-19(18)13-24)23-28(26,27)14-20-11-16(3)5-6-17(20)4/h5-8,11-12,15,23H,9-10,13-14H2,1-4H3