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

Systemtic Name: 2-[(5-naphthalen-1-yl-4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[5-(1-naphthyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[5-(1-naphthalenyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(5-naphthalen-1-yl-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[4-keto-5-(1-naphthyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-(2-thenyl)acetamide Formula: C22H17N5O2S2 MolecularWeight: 447.53268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=C(NN=C4)N=C3SCC(=O)NCC5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=C(NN=C4)N=C3SCC(=O)NCC5=CC=CS5

InChI

InChI=1S/C22H17N5O2S2/c28-19(23-11-15-7-4-10-30-15)13-31-22-25-20-17(12-24-26-20)21(29)27(22)18-9-3-6-14-5-1-2-8-16(14)18/h1-10,12H,11,13H2,(H,23,28)(H,24,26)