2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-1H-pyrimidin-4-one Openeye Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-1H-pyrimidin-4-one CAS Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-6-ethyl-1H-pyrimidin-4-one IUPAC Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-1H-pyrimidin-4-one Traditional Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-6-ethyl-1H-pyrimidin-4-one Formula: C15H13BrN4O2S MolecularWeight: 393.25832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC2=NC(=NO2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H13BrN4O2S/c1-2-11-7-12(21)18-15(17-11)23-8-13-19-14(20-22-13)9-3-5-10(16)6-4-9/h3-7H,2,8H2,1H3,(H,17,18,21)