N-[4-[[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide

Systemtic Name: N-[4-[[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide Openeye Name: N-[4-[(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide CAS Name: N-[4-[(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide IUPAC Name: N-[4-[(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide Traditional Name: N-[4-[(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propionamide Formula: C25H25N3O4S MolecularWeight: 463.5487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H25N3O4S/c1-2-24(29)26-21-10-12-23(13-11-21)33(31,32)27-22-9-8-18-14-15-28(17-20(18)16-22)25(30)19-6-4-3-5-7-19/h3-13,16,27H,2,14-15,17H2,1H3,(H,26,29)