azepan-1-yl-(1,3-dimethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)methanone

Systemtic Name: azepan-1-yl-(1,3-dimethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)methanone Openeye Name: azepan-1-yl-[1,3-dimethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]methanone CAS Name: 1-azepanyl-(1,3-dimethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)methanone IUPAC Name: azepan-1-yl-(1,3-dimethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridin-4-yl)methanone Traditional Name: azepan-1-yl-[1,3-dimethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C19H22N4OS/c1-13-17-14(19(24)23-9-5-3-4-6-10-23)12-15(16-8-7-11-25-16)20-18(17)22(2)21-13/h7-8,11-12H,3-6,9-10H2,1-2H3