6-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C17H18N6O2S MolecularWeight: 370.42882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=O)C4=CNNC4=N3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=O)C4=CNNC4=N3

InChI

InChI=1S/C17H18N6O2S/c24-14(11-26-17-19-15-13(10-18-21-15)16(25)20-17)23-8-6-22(7-9-23)12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,18,19,20,21,25)