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

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-ethyl-quinazolin-4-one Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-ethyl-quinazolin-4-one CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-ethyl-4-quinazolinone IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-ethylquinazolin-4-one Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-ethyl-quinazolin-4-one Formula: C19H17BrN2O3S MolecularWeight: 433.31888

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C19H17BrN2O3S/c1-2-22-18(23)13-5-3-4-6-15(13)21-19(22)26-11-12-9-16-17(10-14(12)20)25-8-7-24-16/h3-6,9-10H,2,7-8,11H2,1H3