[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] 2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoate

Systemtic Name: [2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] 2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoate Openeye Name: [2-(4-ethylanilino)-2-oxo-ethyl] 2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]acetic acid [2-(4-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylanilino)-2-oxoethyl] 2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetate Traditional Name: 2-[[2-(2-thenoylamino)acetyl]amino]acetic acid [2-(4-ethylanilino)-2-keto-ethyl] ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C19H21N3O5S/c1-2-13-5-7-14(8-6-13)22-17(24)12-27-18(25)11-20-16(23)10-21-19(26)15-4-3-9-28-15/h3-9H,2,10-12H2,1H3,(H,20,23)(H,21,26)(H,22,24)