N,N-diethyl-2-(3-oxidanylidene-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenyl-ethanamide

Systemtic Name: N,N-diethyl-2-(3-oxidanylidene-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenyl-ethanamide Openeye Name: N,N-diethyl-2-(3-oxo-4-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenyl-acetamide CAS Name: N,N-diethyl-2-(3-oxo-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenylacetamide IUPAC Name: N,N-diethyl-2-(3-oxo-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenylacetamide Traditional Name: N,N-diethyl-2-(3-keto-4-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-5-yl)-2-phenyl-acetamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)N2C=NC3=C(C2=S)C(=O)NN3

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)N2C=NC3=C(C2=S)C(=O)NN3

InChI

InChI=1S/C17H19N5O2S/c1-3-21(4-2)16(24)13(11-8-6-5-7-9-11)22-10-18-14-12(17(22)25)15(23)20-19-14/h5-10,13H,3-4H2,1-2H3,(H2,19,20,23)