O2-tert-butyl O4-ethyl 3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 3-methyl-5-(pyridine-4-carbonylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo(pyridin-4-yl)methyl]amino]thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 3-methyl-5-(pyridine-4-carbonylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-isonicotinamido-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5S/c1-6-25-17(23)13-11(2)14(18(24)26-19(3,4)5)27-16(13)21-15(22)12-7-9-20-10-8-12/h7-10H,6H2,1-5H3,(H,21,22)