[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C19H18N2O4S/c1-2-13-5-7-14(8-6-13)19-20-17(25-21-19)12-24-18(23)10-9-15(22)16-4-3-11-26-16/h3-8,11H,2,9-10,12H2,1H3