N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-(methylsulfonylamino)benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-(methylsulfonylamino)benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-(methanesulfonamido)benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutyl]-3-(methanesulfonamido)benzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutyl]-3-(methanesulfonamido)benzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-3-(methanesulfonamido)benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)C(CNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H29N3O3S/c1-16(2)21(25-12-11-17-7-4-5-8-19(17)15-25)14-23-22(26)18-9-6-10-20(13-18)24-29(3,27)28/h4-10,13,16,21,24H,11-12,14-15H2,1-3H3,(H,23,26)