azepan-1-yl-(3-cyclopropyl-6-ethyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)methanone

Systemtic Name: azepan-1-yl-(3-cyclopropyl-6-ethyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)methanone Openeye Name: azepan-1-yl-(3-cyclopropyl-6-ethyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)methanone CAS Name: 1-azepanyl-(3-cyclopropyl-6-ethyl-1-phenyl-4-pyrazolo[3,4-b]pyridinyl)methanone IUPAC Name: azepan-1-yl-(3-cyclopropyl-6-ethyl-1-phenylpyrazolo[3,4-b]pyridin-4-yl)methanone Traditional Name: azepan-1-yl-(3-cyclopropyl-6-ethyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)methanone Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C1)C(=O)N3CCCCCC3)C(=NN2C4=CC=CC=C4)C5CC5

Isomeric SMILES

CCC1=NC2=C(C(=C1)C(=O)N3CCCCCC3)C(=NN2C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C24H28N4O/c1-2-18-16-20(24(29)27-14-8-3-4-9-15-27)21-22(17-12-13-17)26-28(23(21)25-18)19-10-6-5-7-11-19/h5-7,10-11,16-17H,2-4,8-9,12-15H2,1H3