[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CCNC(=O)C2=CC=CS2

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CCNC(=O)C2=CC=CS2

InChI

InChI=1S/C20H23NO4S/c1-3-14-7-8-15(4-2)16(12-14)17(22)13-25-19(23)9-10-21-20(24)18-6-5-11-26-18/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,21,24)