methyl 2-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate

Systemtic Name: methyl 2-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate Openeye Name: methyl 2-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoate CAS Name: 2-[[1-oxo-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate Traditional Name: 2-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C18H17N3O4S/c1-24-18(23)12-6-2-3-7-13(12)19-15(22)9-4-10-16-20-17(21-25-16)14-8-5-11-26-14/h2-3,5-8,11H,4,9-10H2,1H3,(H,19,22)