N-butyl-4-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-butyl-4-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-butyl-4-[1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carbonyl]piperazine-1-carboxamide CAS Name: N-butyl-4-[[1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carbonyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carbonyl]piperazine-1-carboxamide Formula: C23H35N7O3 MolecularWeight: 457.5691

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1)C(=O)C2=CN=C3C(=C2NC4CCOCC4)C=NN3CC

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1)C(=O)C2=CN=C3C(=C2NC4CCOCC4)C=NN3CC

InChI

InChI=1S/C23H35N7O3/c1-3-5-8-24-23(32)29-11-9-28(10-12-29)22(31)19-15-25-21-18(16-26-30(21)4-2)20(19)27-17-6-13-33-14-7-17/h15-17H,3-14H2,1-2H3,(H,24,32)(H,25,27)