3-[5,5-bis(oxidanylidene)dibenzothiophen-2-yl]-5-(phenylmethyl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one

Systemtic Name: 3-[5,5-bis(oxidanylidene)dibenzothiophen-2-yl]-5-(phenylmethyl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one Openeye Name: 5-benzyl-3-(5,5-dioxodibenzothiophen-2-yl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one CAS Name: 3-(5,5-dioxo-2-dibenzothiophenyl)-5-(phenylmethyl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one IUPAC Name: 5-benzyl-3-(5,5-dioxodibenzothiophen-2-yl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one Traditional Name: 5-benzyl-3-(5,5-diketodibenzothiophen-2-yl)-4,4a-dihydropyridazino[3,4-b][1,4]oxazin-6-one Formula: C25H19N3O4S MolecularWeight: 457.50106

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(=NN=C1C3=CC4=C(C=C3)S(=O)(=O)C5=CC=CC=C54)OCC(=O)N2CC6=CC=CC=C6

Isomeric SMILES

C1C2C(=NN=C1C3=CC4=C(C=C3)S(=O)(=O)C5=CC=CC=C54)OCC(=O)N2CC6=CC=CC=C6

InChI

InChI=1S/C25H19N3O4S/c29-24-15-32-25-21(28(24)14-16-6-2-1-3-7-16)13-20(26-27-25)17-10-11-23-19(12-17)18-8-4-5-9-22(18)33(23,30)31/h1-12,21H,13-15H2