diethyl 3-methyl-5-(pyrazolo[1,5-a]pyrimidin-2-ylcarbonylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(pyrazolo[1,5-a]pyrimidin-2-ylcarbonylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo(2-pyrazolo[1,5-a]pyrimidinyl)methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN3C=CC=NC3=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN3C=CC=NC3=C2

InChI

InChI=1S/C18H18N4O5S/c1-4-26-17(24)13-10(3)14(18(25)27-5-2)28-16(13)20-15(23)11-9-12-19-7-6-8-22(12)21-11/h6-9H,4-5H2,1-3H3,(H,20,23)