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

Systemtic Name: azepan-1-yl-[6-(5-methylthiophen-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]methanone Openeye Name: azepan-1-yl-[1-isopropyl-6-(5-methyl-2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]methanone CAS Name: 1-azepanyl-[6-(5-methyl-2-thiophenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-[6-(5-methylthiophen-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl]methanone Traditional Name: azepan-1-yl-[1-isopropyl-6-(5-methyl-2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4OS/c1-14(2)25-20-17(13-22-25)16(21(26)24-10-6-4-5-7-11-24)12-18(23-20)19-9-8-15(3)27-19/h8-9,12-14H,4-7,10-11H2,1-3H3