diethyl 3-methyl-5-[[5-(pyrazol-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[5-(pyrazol-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[5-(1-pyrazolylmethyl)-2-furanyl]methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[5-(pyrazol-1-ylmethyl)-2-furoyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)CN3C=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)CN3C=CC=N3

InChI

InChI=1S/C20H21N3O6S/c1-4-27-19(25)15-12(3)16(20(26)28-5-2)30-18(15)22-17(24)14-8-7-13(29-14)11-23-10-6-9-21-23/h6-10H,4-5,11H2,1-3H3,(H,22,24)