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

Systemtic Name: diethyl 3-methyl-5-[[1-(phenoxymethyl)pyrazol-3-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[1-(phenoxymethyl)-3-pyrazolyl]methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O6S/c1-4-29-21(27)17-14(3)18(22(28)30-5-2)32-20(17)23-19(26)16-11-12-25(24-16)13-31-15-9-7-6-8-10-15/h6-12H,4-5,13H2,1-3H3,(H,23,26)