2-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-[2-(2-thienyl)ethyl]acetamide Formula: C19H17N5O2S2 MolecularWeight: 411.50058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C19H17N5O2S2/c25-16(20-9-8-14-7-4-10-27-14)12-28-19-22-17-15(18(26)23-19)11-21-24(17)13-5-2-1-3-6-13/h1-7,10-11,21H,8-9,12H2,(H,20,25)