dimethyl 3-methyl-5-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[2-(methylthio)anilino]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[2-(methylthio)anilino]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC=CC=C2SC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC=CC=C2SC)C(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-10-14(17(22)24-2)16(27-15(10)18(23)25-3)20-13(21)9-19-11-7-5-6-8-12(11)26-4/h5-8,19H,9H2,1-4H3,(H,20,21)