[2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl] 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid [2-keto-2-(3-methylbenzothiophen-2-yl)ethyl] ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H16N2O4S2/c1-12-13-5-2-3-6-15(13)28-19(12)14(23)11-25-18(24)9-8-17-21-20(22-26-17)16-7-4-10-27-16/h2-7,10H,8-9,11H2,1H3