N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-methoxy-benzofuran-2-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-7-methoxy-2-benzofurancarboxamide IUPAC Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-methoxy-coumarilamide Formula: C22H26N6O4S MolecularWeight: 470.54464

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC4=C(O3)C(=CC=C4)OC)C(=N1)NCCOC

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC4=C(O3)C(=CC=C4)OC)C(=N1)NCCOC

InChI

InChI=1S/C22H26N6O4S/c1-4-33-22-26-19(23-9-11-30-2)15-13-25-28(20(15)27-22)10-8-24-21(29)17-12-14-6-5-7-16(31-3)18(14)32-17/h5-7,12-13H,4,8-11H2,1-3H3,(H,24,29)(H,23,26,27)