N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-methyl-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-methyl-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-methyl-2-oxo-pyridine-3-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-1-methyl-2-oxo-3-pyridinecarboxamide IUPAC Name: N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-methyl-2-oxopyridine-3-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-keto-1-methyl-nicotinamide Formula: C19H25N7O3S MolecularWeight: 431.5119

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC=CN(C3=O)C)C(=N1)NCCOC

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC=CN(C3=O)C)C(=N1)NCCOC

InChI

InChI=1S/C19H25N7O3S/c1-4-30-19-23-15(20-8-11-29-3)14-12-22-26(16(14)24-19)10-7-21-17(27)13-6-5-9-25(2)18(13)28/h5-6,9,12H,4,7-8,10-11H2,1-3H3,(H,21,27)(H,20,23,24)