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

Systemtic Name: 1-[5-(3-chloranyl-5-phenoxy-1-benzothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]-2-(3-methoxy-4-oxidanyl-phenyl)ethanone Openeye Name: 1-[5-(3-chloro-5-phenoxy-benzothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]-2-(4-hydroxy-3-methoxy-phenyl)ethanone CAS Name: 1-[5-(3-chloro-5-phenoxy-1-benzothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]-2-(4-hydroxy-3-methoxyphenyl)ethanone IUPAC Name: 1-[5-(3-chloro-5-phenoxy-1-benzothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]-2-(4-hydroxy-3-methoxyphenyl)ethanone Traditional Name: 1-[5-(3-chloro-5-phenoxy-benzothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]-2-(4-hydroxy-3-methoxy-phenyl)ethanone Formula: C25H19ClN2O5S MolecularWeight: 494.94676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)N2COC(=N2)C3=C(C4=C(S3)C=CC(=C4)OC5=CC=CC=C5)Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)N2COC(=N2)C3=C(C4=C(S3)C=CC(=C4)OC5=CC=CC=C5)Cl)O

InChI

InChI=1S/C25H19ClN2O5S/c1-31-20-11-15(7-9-19(20)29)12-22(30)28-14-32-25(27-28)24-23(26)18-13-17(8-10-21(18)34-24)33-16-5-3-2-4-6-16/h2-11,13,29H,12,14H2,1H3