dimethyl 5-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=NNC(=C2)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=NNC(=C2)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C18H15N3O5S/c1-25-17(23)10-6-11(18(24)26-2)8-12(7-10)19-16(22)14-9-13(20-21-14)15-4-3-5-27-15/h3-9H,1-2H3,(H,19,22)(H,20,21)