3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-quinolin-5-yl-benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-quinolin-5-yl-benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-quinolyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-quinolinyl)benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-quinolin-5-ylbenzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-quinolyl)benzamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C25H21N3O3S/c29-25(27-24-12-4-11-23-22(24)10-5-14-26-23)19-8-3-9-21(16-19)32(30,31)28-15-13-18-6-1-2-7-20(18)17-28/h1-12,14,16H,13,15,17H2,(H,27,29)