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

Systemtic Name: 2-[1-(2-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[1-(2-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(1-naphthyl)acetamide CAS Name: 2-[[1-(2-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[1-(2-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-naphthalen-1-ylacetamide Traditional Name: 2-[[1-(2-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]-N-(1-naphthyl)acetamide Formula: C23H16ClN5OS MolecularWeight: 445.92404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5Cl

InChI

InChI=1S/C23H16ClN5OS/c24-18-9-3-4-11-20(18)29-22-17(12-27-29)23(26-14-25-22)31-13-21(30)28-19-10-5-7-15-6-1-2-8-16(15)19/h1-12,14H,13H2,(H,28,30)