8-methoxy-N-[2-[4-(2-methylpropylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: 8-methoxy-N-[2-[4-(2-methylpropylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[2-[4-(isobutylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxo-chromene-3-carboxamide CAS Name: 8-methoxy-N-[2-[4-(2-methylpropylamino)-6-(methylthio)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: 8-methoxy-N-[2-[4-(2-methylpropylamino)-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-oxochromene-3-carboxamide Traditional Name: N-[2-[4-(isobutylamino)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-keto-8-methoxy-chromene-3-carboxamide Formula: C23H26N6O4S MolecularWeight: 482.55534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O)SC

Isomeric SMILES

CC(C)CNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O)SC

InChI

InChI=1S/C23H26N6O4S/c1-13(2)11-25-19-16-12-26-29(20(16)28-23(27-19)34-4)9-8-24-21(30)15-10-14-6-5-7-17(32-3)18(14)33-22(15)31/h5-7,10,12-13H,8-9,11H2,1-4H3,(H,24,30)(H,25,27,28)