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

Systemtic Name: N-[2-[6-ethylsulfanyl-4-(2-methylpropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(isobutylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(2-methylpropylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-8-methoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[2-[6-ethylsulfanyl-4-(2-methylpropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-8-methoxy-2-oxochromene-3-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-(isobutylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-keto-8-methoxy-chromene-3-carboxamide Formula: C24H28N6O4S MolecularWeight: 496.58192

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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)NCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H28N6O4S/c1-5-35-24-28-20(26-12-14(2)3)17-13-27-30(21(17)29-24)10-9-25-22(31)16-11-15-7-6-8-18(33-4)19(15)34-23(16)32/h6-8,11,13-14H,5,9-10,12H2,1-4H3,(H,25,31)(H,26,28,29)