3-(3-chloranyl-4-fluoranyl-phenyl)-2-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-2-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-[[5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-chloro-4-fluorophenyl)-2-[[5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-fluorophenyl)-2-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-[[5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methylthio]quinazolin-4-one Formula: C21H12ClFN4O2S2 MolecularWeight: 470.926983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NOC(=N3)C4=CSC=C4)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NOC(=N3)C4=CSC=C4)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C21H12ClFN4O2S2/c22-15-9-13(5-6-16(15)23)27-20(28)14-3-1-2-4-17(14)24-21(27)31-11-18-25-19(29-26-18)12-7-8-30-10-12/h1-10H,11H2