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

Systemtic Name: N-cyclohexyl-2-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-cyclohexyl-2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-cyclohexyl-2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-phenylacetamide IUPAC Name: N-cyclohexyl-2-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-cyclohexyl-2-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-phenyl-acetamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CSC3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CSC3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O2S/c31-22(29(18-10-4-1-5-11-18)19-12-6-2-7-13-19)17-33-25-27-23-21(24(32)28-25)16-26-30(23)20-14-8-3-9-15-20/h1,3-5,8-11,14-16,19,26H,2,6-7,12-13,17H2