6-bromanyl-2-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-6-bromo-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-6-bromo-3-propylquinazolin-4-one Traditional Name: 2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylthio]-6-bromo-3-propyl-quinazolin-4-one Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=NC(=NO3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=NC(=NO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H19BrN4O2S/c1-2-10-26-20(27)16-12-15(22)8-9-17(16)23-21(26)29-13-19-24-18(25-28-19)11-14-6-4-3-5-7-14/h3-9,12H,2,10-11,13H2,1H3