ethyl 4-[2-[3-(thiophen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(thiophen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[2-[3-(thiophene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 4-[[1-oxo-2-[[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]thio]propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-(thiophene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[[3-(2-thenoylamino)phenyl]thio]propanoylamino]benzoic acid ethyl ester Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H22N2O4S2/c1-3-29-23(28)16-9-11-17(12-10-16)24-21(26)15(2)31-19-7-4-6-18(14-19)25-22(27)20-8-5-13-30-20/h4-15H,3H2,1-2H3,(H,24,26)(H,25,27)