dimethyl 4-azanyl-1-phenyl-3-thiophen-2-yl-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate

Systemtic Name: dimethyl 4-azanyl-1-phenyl-3-thiophen-2-yl-pyrazolo[3,4-b]pyridine-5,6-dicarboxylate Openeye Name: dimethyl 4-amino-1-phenyl-3-(2-thienyl)pyrazolo[3,4-b]pyridine-5,6-dicarboxylate CAS Name: 4-amino-1-phenyl-3-thiophen-2-ylpyrazolo[3,4-b]pyridine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-amino-1-phenyl-3-thiophen-2-ylpyrazolo[3,4-b]pyridine-5,6-dicarboxylate Traditional Name: 4-amino-1-phenyl-3-(2-thienyl)pyrazolo[3,4-b]pyridine-5,6-dicarboxylic acid dimethyl ester Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C2C(=C1N)C(=NN2C3=CC=CC=C3)C4=CC=CS4)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N=C2C(=C1N)C(=NN2C3=CC=CC=C3)C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C20H16N4O4S/c1-27-19(25)14-15(21)13-16(12-9-6-10-29-12)23-24(11-7-4-3-5-8-11)18(13)22-17(14)20(26)28-2/h3-10H,1-2H3,(H2,21,22)