dimethyl 3-methyl-5-[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(o-tolylmethylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[(2-methylphenyl)methylthio]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[(2-methylbenzyl)thio]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C19H21NO5S2/c1-11-7-5-6-8-13(11)9-26-10-14(21)20-17-15(18(22)24-3)12(2)16(27-17)19(23)25-4/h5-8H,9-10H2,1-4H3,(H,20,21)