3-[[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]sulfonylamino]-N-phenyl-propanamide

Systemtic Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]sulfonylamino]-N-phenyl-propanamide Openeye Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-phenyl-propanamide CAS Name: 3-[[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]sulfonylamino]-N-phenylpropanamide IUPAC Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-phenylpropanamide Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]sulfonylamino]-N-phenyl-propionamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3S(=O)(=O)NCCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3S(=O)(=O)NCCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4S/c29-24(27-21-10-2-1-3-11-21)14-16-26-33(31,32)23-13-7-6-12-22(23)25(30)28-17-15-19-8-4-5-9-20(19)18-28/h1-13,26H,14-18H2,(H,27,29)