1-[5-(3-chloranyl-5-phenoxy-1-benzothiophen-2-yl)-2-(4-methylsulfanylphenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Systemtic Name: 1-[5-(3-chloranyl-5-phenoxy-1-benzothiophen-2-yl)-2-(4-methylsulfanylphenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Openeye Name: 1-[5-(3-chloro-5-phenoxy-benzothiophen-2-yl)-2-(4-methylsulfanylphenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone CAS Name: 1-[5-(3-chloro-5-phenoxy-1-benzothiophen-2-yl)-2-[4-(methylthio)phenyl]-2H-1,3,4-oxadiazol-3-yl]ethanone IUPAC Name: 1-[5-(3-chloro-5-phenoxy-1-benzothiophen-2-yl)-2-(4-methylsulfanylphenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Traditional Name: 1-[5-(3-chloro-5-phenoxy-benzothiophen-2-yl)-2-[4-(methylthio)phenyl]-2H-1,3,4-oxadiazol-3-yl]ethanone Formula: C25H19ClN2O3S2 MolecularWeight: 495.01296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(OC(=N1)C2=C(C3=C(S2)C=CC(=C3)OC4=CC=CC=C4)Cl)C5=CC=C(C=C5)SC

Isomeric SMILES

CC(=O)N1C(OC(=N1)C2=C(C3=C(S2)C=CC(=C3)OC4=CC=CC=C4)Cl)C5=CC=C(C=C5)SC

InChI

InChI=1S/C25H19ClN2O3S2/c1-15(29)28-25(16-8-11-19(32-2)12-9-16)31-24(27-28)23-22(26)20-14-18(10-13-21(20)33-23)30-17-6-4-3-5-7-17/h3-14,25H,1-2H3