diethyl 3-methyl-5-[2-(pyridin-3-ylmethylamino)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(pyridin-3-ylmethylamino)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(3-pyridylmethylamino)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(3-pyridinylmethylamino)ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(pyridin-3-ylmethylamino)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-pyridylmethylamino)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O5S/c1-4-26-18(24)15-12(3)16(19(25)27-5-2)28-17(15)22-14(23)11-21-10-13-7-6-8-20-9-13/h6-9,21H,4-5,10-11H2,1-3H3,(H,22,23)