2-(2-ethyl-7-oxidanylidene-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-(2-ethyl-7-oxidanylidene-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-(2-ethyl-7-oxo-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[(2-ethyl-7-oxo-6-phenethyl-5-pyrazolo[4,3-d]pyrimidinyl)thio]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-(2-ethyl-7-oxo-6-phenethylpyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[(2-ethyl-7-keto-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)thio]-N-[3-(methylthio)phenyl]acetamide Formula: C24H25N5O2S2 MolecularWeight: 479.6176

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)SC)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)SC)CCC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O2S2/c1-3-28-15-20-22(27-28)23(31)29(13-12-17-8-5-4-6-9-17)24(26-20)33-16-21(30)25-18-10-7-11-19(14-18)32-2/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,25,30)