2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[C@H]2C3=CC=CC=C3C=CN2C(=O)C)S(=O)(=O)NC

InChI

InChI=1S/C21H23N3O4S/c1-14-8-9-17(12-20(14)29(27,28)22-3)23-21(26)13-19-18-7-5-4-6-16(18)10-11-24(19)15(2)25/h4-12,19,22H,13H2,1-3H3,(H,23,26)/t19-/m0/s1