2-[[5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-hexyl-quinazolin-4-one

Systemtic Name: 2-[[5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-hexyl-quinazolin-4-one Openeye Name: 2-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-hexyl-quinazolin-4-one CAS Name: 2-[[5-(5-bromo-2-furanyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-hexyl-4-quinazolinone IUPAC Name: 2-[[5-(5-bromofuran-2-yl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-hexylquinazolin-4-one Traditional Name: 2-[[5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-hexyl-quinazolin-4-one Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=C(O4)Br

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=C(O4)Br

InChI

InChI=1S/C21H21BrN4O3S/c1-2-3-4-7-12-26-20(27)14-8-5-6-9-15(14)23-21(26)30-13-18-24-25-19(29-18)16-10-11-17(22)28-16/h5-6,8-11H,2-4,7,12-13H2,1H3