propan-2-yl 4-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]benzoate Openeye Name: isopropyl 4-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]benzoate Traditional Name: 4-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid isopropyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C19H19N3O4S/c1-12(2)25-19(24)13-5-7-14(8-6-13)20-16(23)9-10-17-21-18(22-26-17)15-4-3-11-27-15/h3-8,11-12H,9-10H2,1-2H3,(H,20,23)