N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-N-(3-methylphenyl)methanesulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-N-(3-methylphenyl)methanesulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]-N-(m-tolyl)methanesulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-N-(3-methylphenyl)methanesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-N-(3-methylphenyl)methanesulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]-N-(m-tolyl)methanesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O3S/c1-17-7-5-10-20(15-17)23(27(2,25)26)13-6-11-21(24)22-14-12-18-8-3-4-9-19(18)16-22/h3-5,7-10,15H,6,11-14,16H2,1-2H3