N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butyramide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCCC2=NC(=NO2)C3=CC=CS3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCCC2=NC(=NO2)C3=CC=CS3)Br)OC

InChI

InChI=1S/C20H22BrN3O4S/c1-26-15-11-13(14(21)12-16(15)27-2)8-9-22-18(25)6-3-7-19-23-20(24-28-19)17-5-4-10-29-17/h4-5,10-12H,3,6-9H2,1-2H3,(H,22,25)