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

Systemtic Name: dimethyl 3-methyl-5-[[1-(pyrazol-1-ylmethyl)pyrazol-3-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[1-(1-pyrazolylmethyl)-3-pyrazolyl]methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H17N5O5S MolecularWeight: 403.41238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O5S/c1-10-12(16(24)26-2)15(28-13(10)17(25)27-3)19-14(23)11-5-8-22(20-11)9-21-7-4-6-18-21/h4-8H,9H2,1-3H3,(H,19,23)