6-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(1-butyltetrazol-5-yl)methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(1-butyl-5-tetrazolyl)methylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(1-butyltetrazol-5-yl)methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(1-butyltetrazol-5-yl)methylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H18N8OS MolecularWeight: 382.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C17H18N8OS/c1-2-3-9-24-14(21-22-23-24)11-27-17-19-15-13(16(26)20-17)10-18-25(15)12-7-5-4-6-8-12/h4-8,10,18H,2-3,9,11H2,1H3