propan-2-yl 3-(2-nitrophenyl)-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[1-oxo-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]propanoate Traditional Name: 3-(2-nitrophenyl)-3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]propionic acid isopropyl ester Formula: C22H24N4O6S MolecularWeight: 472.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C22H24N4O6S/c1-14(2)31-21(28)13-16(15-7-3-4-8-17(15)26(29)30)23-19(27)10-5-11-20-24-22(25-32-20)18-9-6-12-33-18/h3-4,6-9,12,14,16H,5,10-11,13H2,1-2H3,(H,23,27)