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

Systemtic Name: N-[2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(isopropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(propan-2-ylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-8-methoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxochromene-3-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-(isopropylamino)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:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O)C(=N1)NC(C)C

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O)C(=N1)NC(C)C

InChI

InChI=1S/C23H26N6O4S/c1-5-34-23-27-19(26-13(2)3)16-12-25-29(20(16)28-23)10-9-24-21(30)15-11-14-7-6-8-17(32-4)18(14)33-22(15)31/h6-8,11-13H,5,9-10H2,1-4H3,(H,24,30)(H,26,27,28)