4-chloranyl-3-methyl-N-(2-methyl-6-nitro-phenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-chloranyl-3-methyl-N-(2-methyl-6-nitro-phenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-chloro-3-methyl-N-(2-methyl-6-nitro-phenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-chloro-3-methyl-N-(2-methyl-6-nitrophenyl)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-chloro-3-methyl-N-(2-methyl-6-nitrophenyl)-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-chloro-3-methyl-N-(2-methyl-6-nitro-phenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H16ClN5O3 MolecularWeight: 421.83644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C2=CN=C3C(=C2Cl)C(=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C2=CN=C3C(=C2Cl)C(=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C21H16ClN5O3/c1-12-7-6-10-16(27(29)30)19(12)24-21(28)15-11-23-20-17(18(15)22)13(2)25-26(20)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,24,28)