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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)N4CCCCCC4

InChI

InChI=1S/C19H22N4OS/c1-14-11-16(19(24)22-8-4-2-3-5-9-22)17-12-20-23(18(17)21-14)13-15-7-6-10-25-15/h6-7,10-12H,2-5,8-9,13H2,1H3