(2R)-N-(3-ethanoylphenyl)-2-phenyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: (2R)-N-(3-ethanoylphenyl)-2-phenyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: (2R)-N-(3-acetylphenyl)-2-phenyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: (2R)-N-(3-acetylphenyl)-2-phenyl-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]acetamide IUPAC Name: (2R)-N-(3-acetylphenyl)-2-phenyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: (2R)-N-(3-acetylphenyl)-2-phenyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C27H21N5O2S MolecularWeight: 479.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@@H](C2=CC=CC=C2)SC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C27H21N5O2S/c1-18(33)20-11-8-12-21(15-20)31-26(34)24(19-9-4-2-5-10-19)35-27-23-16-30-32(25(23)28-17-29-27)22-13-6-3-7-14-22/h2-17,24H,1H3,(H,31,34)/t24-/m1/s1