azepan-1-yl-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]methanone

Systemtic Name: azepan-1-yl-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]methanone Openeye Name: azepan-1-yl-[6-(2,5-dimethyl-3-thienyl)-1-isopropyl-pyrazolo[3,4-b]pyridin-4-yl]methanone CAS Name: 1-azepanyl-[6-(2,5-dimethyl-3-thiophenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl]methanone Traditional Name: azepan-1-yl-[6-(2,5-dimethyl-3-thienyl)-1-isopropyl-pyrazolo[3,4-b]pyridin-4-yl]methanone Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H28N4OS/c1-14(2)26-21-19(13-23-26)18(22(27)25-9-7-5-6-8-10-25)12-20(24-21)17-11-15(3)28-16(17)4/h11-14H,5-10H2,1-4H3