1-phenyl-6-prop-2-ynylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-phenyl-6-prop-2-ynylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-phenyl-6-prop-2-ynylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-phenyl-6-(prop-2-ynylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-phenyl-6-prop-2-ynylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-phenyl-6-(propargylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H10N4OS MolecularWeight: 282.3204

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=CC=C3

Isomeric SMILES

C#CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=CC=C3

InChI

InChI=1S/C14H10N4OS/c1-2-8-20-14-16-12-11(13(19)17-14)9-15-18(12)10-6-4-3-5-7-10/h1,3-7,9,15H,8H2