O2-methyl O4-propyl 3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-propyl 3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2,4-dicarboxylate Openeye Name: O2-methyl O4-propyl 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-methyl ester O4-propyl ester IUPAC Name: 2-O-methyl 4-O-propyl 3-methyl-5-(pyridine-4-carbonylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-isonicotinamido-3-methyl-thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-4-9-24-16(21)12-10(2)13(17(22)23-3)25-15(12)19-14(20)11-5-7-18-8-6-11/h5-8H,4,9H2,1-3H3,(H,19,20)