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

Systemtic Name: dimethyl 5-[2-[(3-chlorophenyl)amino]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[2-(3-chloroanilino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(3-chloroanilino)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(3-chloroanilino)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(3-chloroanilino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C17H17ClN2O5S/c1-9-13(16(22)24-2)15(26-14(9)17(23)25-3)20-12(21)8-19-11-6-4-5-10(18)7-11/h4-7,19H,8H2,1-3H3,(H,20,21)