N-(4-acetamido-3-chloranyl-phenyl)-1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H18ClN5O2S MolecularWeight: 439.91792

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC(=C(C=C4)NC(=O)C)Cl

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC(=C(C=C4)NC(=O)C)Cl

InChI

InChI=1S/C21H18ClN5O2S/c1-3-27-20-15(11-23-27)14(10-18(26-20)19-5-4-8-30-19)21(29)25-13-6-7-17(16(22)9-13)24-12(2)28/h4-11H,3H2,1-2H3,(H,24,28)(H,25,29)