N-[3-methyl-4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[3-methyl-4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]ethanamide Openeye Name: N-[3-methyl-4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]acetamide CAS Name: N-[3-methyl-4-[[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[3-methyl-4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]acetamide Traditional Name: N-[3-methyl-4-[(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)NC(=O)C)C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C21H25N3O4S/c1-4-21(26)24-10-9-16-5-6-19(12-17(16)13-24)23-29(27,28)20-8-7-18(11-14(20)2)22-15(3)25/h5-8,11-12,23H,4,9-10,13H2,1-3H3,(H,22,25)