N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]-2,1,3-benzoxadiazole-4-sulfonamide

Systemtic Name: N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]-2,1,3-benzoxadiazole-4-sulfonamide Openeye Name: N-[2-[(1-phenylethylamino)methyl]chroman-7-yl]-2,1,3-benzoxadiazole-4-sulfonamide CAS Name: N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-1-benzopyran-7-yl]-2,1,3-benzoxadiazole-4-sulfonamide IUPAC Name: N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]-2,1,3-benzoxadiazole-4-sulfonamide Traditional Name: N-[2-[(1-phenylethylamino)methyl]chroman-7-yl]benzofurazan-4-sulfonamide Formula: C24H24N4O4S MolecularWeight: 464.53676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=CC5=NON=C54

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=CC5=NON=C54

InChI

InChI=1S/C24H24N4O4S/c1-16(17-6-3-2-4-7-17)25-15-20-13-11-18-10-12-19(14-22(18)31-20)28-33(29,30)23-9-5-8-21-24(23)27-32-26-21/h2-10,12,14,16,20,25,28H,11,13,15H2,1H3