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

Systemtic Name: 2-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-isopropylphenyl)acetamide CAS Name: 2-[[1-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-p-cumenyl-acetamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C23H23N5OS/c1-16(2)18-8-10-19(11-9-18)27-21(29)14-30-23-20-12-26-28(22(20)24-15-25-23)13-17-6-4-3-5-7-17/h3-12,15-16H,13-14H2,1-2H3,(H,27,29)