N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoxaline-2-carboxamide Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H20N4O3S/c29-24(23-15-25-21-8-4-5-9-22(21)27-23)26-19-11-10-17-12-13-28(16-18(17)14-19)32(30,31)20-6-2-1-3-7-20/h1-11,14-15H,12-13,16H2,(H,26,29)