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

Systemtic Name: ethyl 2-[2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[2-keto-2-(p-anisidino)ethyl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H22N2O5S/c1-3-27-20(25)16-6-4-5-7-17(16)22-19(24)13-28-12-18(23)21-14-8-10-15(26-2)11-9-14/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H,22,24)