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

Systemtic Name: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-butyl-quinazolin-4-one Openeye Name: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-butyl-quinazolin-4-one CAS Name: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-butyl-4-quinazolinone IUPAC Name: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-butylquinazolin-4-one Traditional Name: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-butyl-quinazolin-4-one Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O2S/c1-2-3-12-26-20(27)16-6-4-5-7-17(16)23-21(26)29-13-18-24-25-19(28-18)14-8-10-15(22)11-9-14/h4-11H,2-3,12-13H2,1H3