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

Systemtic Name: dimethyl 3-methyl-5-[[5-(pyrazol-1-ylmethyl)furan-2-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C18H17N3O6S MolecularWeight: 403.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(O2)CN3C=CC=N3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(O2)CN3C=CC=N3)C(=O)OC

InChI

InChI=1S/C18H17N3O6S/c1-10-13(17(23)25-2)16(28-14(10)18(24)26-3)20-15(22)12-6-5-11(27-12)9-21-8-4-7-19-21/h4-8H,9H2,1-3H3,(H,20,22)