2-[(5-naphthalen-1-yl-4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(5-naphthalen-1-yl-4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(1-naphthyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-(1-naphthalenyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[(5-naphthalen-1-yl-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[4-keto-5-(1-naphthyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-phenethyl-acetamide Formula: C25H21N5O2S MolecularWeight: 455.53154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H21N5O2S/c31-22(26-14-13-17-7-2-1-3-8-17)16-33-25-28-23-20(15-27-29-23)24(32)30(25)21-12-6-10-18-9-4-5-11-19(18)21/h1-12,15H,13-14,16H2,(H,26,31)(H,27,29)