[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C16H11BrN2O3S MolecularWeight: 391.23914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NOC(=N2)COC(=O)C=CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NOC(=N2)COC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C16H11BrN2O3S/c17-12-4-1-3-11(9-12)16-18-14(22-19-16)10-21-15(20)7-6-13-5-2-8-23-13/h1-9H,10H2/b7-6+