diethyl 3-methyl-5-[2-[(phenylmethyl)amino]ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-[(phenylmethyl)amino]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(benzylamino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[(phenylmethyl)amino]ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(benzylamino)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(benzylamino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CNCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CNCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O5S/c1-4-26-19(24)16-13(3)17(20(25)27-5-2)28-18(16)22-15(23)12-21-11-14-9-7-6-8-10-14/h6-10,21H,4-5,11-12H2,1-3H3,(H,22,23)