butyl 4-[2-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-(2-ethoxyanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[2-(2-ethoxyanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[2-keto-2-(o-phenetidino)ethyl]thio]acetyl]amino]benzoic acid butyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC=C2OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC=C2OCC

InChI

InChI=1S/C23H28N2O5S/c1-3-5-14-30-23(28)17-10-12-18(13-11-17)24-21(26)15-31-16-22(27)25-19-8-6-7-9-20(19)29-4-2/h6-13H,3-5,14-16H2,1-2H3,(H,24,26)(H,25,27)