6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(2-morpholino-2-oxo-ethyl)sulfanyl-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(2-keto-2-morpholino-ethyl)thio]-1-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H16N6O5S MolecularWeight: 416.41114

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O5S/c24-14(21-5-7-28-8-6-21)10-29-17-19-15-13(16(25)20-17)9-18-22(15)11-1-3-12(4-2-11)23(26)27/h1-4,9,18H,5-8,10H2