dimethyl 2-[2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanylacetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[[2-keto-2-(p-anisidino)ethyl]thio]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O7S/c1-28-15-7-5-14(6-8-15)22-18(24)11-31-12-19(25)23-17-10-13(20(26)29-2)4-9-16(17)21(27)30-3/h4-10H,11-12H2,1-3H3,(H,22,24)(H,23,25)