ethyl 3-[2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetyl]amino]benzoate Traditional Name: 3-[[2-[[2-(2-thenoylamino)acetyl]amino]acetyl]amino]benzoic acid ethyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CNC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CNC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C18H19N3O5S/c1-2-26-18(25)12-5-3-6-13(9-12)21-16(23)11-19-15(22)10-20-17(24)14-7-4-8-27-14/h3-9H,2,10-11H2,1H3,(H,19,22)(H,20,24)(H,21,23)