[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C17H13BrN2O4S MolecularWeight: 421.26512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN=C(O2)COC(=O)CCC(=O)C3=CC=CS3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN=C(O2)COC(=O)CCC(=O)C3=CC=CS3)Br

InChI

InChI=1S/C17H13BrN2O4S/c18-12-5-2-1-4-11(12)17-20-19-15(24-17)10-23-16(22)8-7-13(21)14-6-3-9-25-14/h1-6,9H,7-8,10H2