5-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]-2,1,3-benzoxadiazole

Systemtic Name: 5-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]-2,1,3-benzoxadiazole Openeye Name: 5-[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]-2,1,3-benzoxadiazole CAS Name: 5-[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]-2,1,3-benzoxadiazole IUPAC Name: 5-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]-2,1,3-benzoxadiazole Traditional Name: 5-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]benzofurazan Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC=CC(=C3)C4=CC5=NON=C5C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC=CC(=C3)C4=CC5=NON=C5C=C4)S(=O)(=O)C

InChI

InChI=1S/C25H21N3O3S/c1-25(2,32(3,29)30)20-13-19-8-5-11-26-24(19)21(15-20)18-7-4-6-16(12-18)17-9-10-22-23(14-17)28-31-27-22/h4-15H,1-3H3