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

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-(3-methoxypropyl)-4-quinazolinone IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C21H21BrN2O4S MolecularWeight: 477.37144

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C21H21BrN2O4S/c1-26-8-4-7-24-20(25)15-5-2-3-6-17(15)23-21(24)29-13-14-11-18-19(12-16(14)22)28-10-9-27-18/h2-3,5-6,11-12H,4,7-10,13H2,1H3