methyl (2S)-3-phenyl-2-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]propanoate Openeye Name: methyl (2S)-3-phenyl-2-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoylamino]propanoate CAS Name: (2S)-2-[[1-oxo-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoylamino]propanoate Traditional Name: (2S)-3-phenyl-2-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoylamino]propionic acid methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C19H19N3O4S/c1-25-19(24)14(12-13-6-3-2-4-7-13)20-16(23)9-10-17-21-18(22-26-17)15-8-5-11-27-15/h2-8,11,14H,9-10,12H2,1H3,(H,20,23)/t14-/m0/s1