2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)N3C(COC4=CC=CC=C43)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)N3C(COC4=CC=CC=C43)C5=CC=CC=C5)OC1

InChI

InChI=1S/C25H23NO4S/c27-25(17-31-19-11-12-23-24(15-19)29-14-6-13-28-23)26-20-9-4-5-10-22(20)30-16-21(26)18-7-2-1-3-8-18/h1-5,7-12,15,21H,6,13-14,16-17H2