2-[(4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(4-keto-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-phenethyl-acetamide Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C3=CNNC3=N2

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C3=CNNC3=N2

InChI

InChI=1S/C15H15N5O2S/c21-12(16-7-6-10-4-2-1-3-5-10)9-23-15-18-13-11(8-17-20-13)14(22)19-15/h1-5,8H,6-7,9H2,(H,16,21)(H2,17,18,19,20,22)