N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]thiophene-3-carboxamide

Systemtic Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]thiophene-3-carboxamide Openeye Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]thiophene-3-carboxamide CAS Name: N-[[1-ethyl-6-methyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-3-thiophenecarboxamide IUPAC Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]thiophene-3-carboxamide Traditional Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]thiophene-3-carboxamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CSC=C4)C

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CSC=C4)C

InChI

InChI=1S/C20H25N5O2S/c1-3-25-19-17(11-22-25)18(24-15-4-7-27-8-5-15)16(13(2)23-19)10-21-20(26)14-6-9-28-12-14/h6,9,11-12,15H,3-5,7-8,10H2,1-2H3,(H,21,26)(H,23,24)