2-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(2-phenylphenyl)ethanamide

Systemtic Name: 2-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(2-phenylphenyl)ethanamide Openeye Name: 2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylphenyl)acetamide CAS Name: 2-[[1-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-N-(2-phenylphenyl)acetamide IUPAC Name: 2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylphenyl)acetamide Traditional Name: 2-[(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-(2-phenylphenyl)acetamide Formula: C26H21N5OS MolecularWeight: 451.54284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C26H21N5OS/c32-24(30-23-14-8-7-13-21(23)20-11-5-2-6-12-20)17-33-26-22-15-29-31(25(22)27-18-28-26)16-19-9-3-1-4-10-19/h1-15,18H,16-17H2,(H,30,32)