O2-ethyl O4-methyl 3-methyl-5-(2-pyridin-3-ylcarbonyloxybutanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-methyl 3-methyl-5-(2-pyridin-3-ylcarbonyloxybutanoylamino)thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-methyl 3-methyl-5-[2-(pyridine-3-carbonyloxy)butanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[oxo(3-pyridinyl)methoxy]butyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester IUPAC Name: 2-O-ethyl 4-O-methyl 3-methyl-5-[2-(pyridine-3-carbonyloxy)butanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(2-nicotinoyloxybutanoylamino)thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OC)OC(=O)C2=CN=CC=C2

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OC)OC(=O)C2=CN=CC=C2

InChI

InChI=1S/C20H22N2O7S/c1-5-13(29-18(24)12-8-7-9-21-10-12)16(23)22-17-14(19(25)27-4)11(3)15(30-17)20(26)28-6-2/h7-10,13H,5-6H2,1-4H3,(H,22,23)