4-(dimethylsulfamoyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C22H27N3O4S/c1-15(2)22(27)25-12-11-16-5-8-19(13-18(16)14-25)23-21(26)17-6-9-20(10-7-17)30(28,29)24(3)4/h5-10,13,15H,11-12,14H2,1-4H3,(H,23,26)