methyl 3-[2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[[2-keto-2-(p-anisidino)ethyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C19H20N2O5S/c1-25-16-8-6-14(7-9-16)20-17(22)11-27-12-18(23)21-15-5-3-4-13(10-15)19(24)26-2/h3-10H,11-12H2,1-2H3,(H,20,22)(H,21,23)