4-[[4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholine

Systemtic Name: 4-[[4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholine Openeye Name: 4-[[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholine CAS Name: 4-[[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-2-quinazolinyl]methyl]morpholine IUPAC Name: 4-[[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholine Traditional Name: 4-[[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]quinazolin-2-yl]methyl]morpholine Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC4=CC5=C(C=C4Br)OCCO5

Isomeric SMILES

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC4=CC5=C(C=C4Br)OCCO5

InChI

InChI=1S/C22H22BrN3O3S/c23-17-12-20-19(28-9-10-29-20)11-15(17)14-30-22-16-3-1-2-4-18(16)24-21(25-22)13-26-5-7-27-8-6-26/h1-4,11-12H,5-10,13-14H2