5-azanyl-1-phenyl-6-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-azanyl-1-phenyl-6-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-allylsulfanyl-5-amino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-amino-1-phenyl-6-(prop-2-enylthio)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-amino-1-phenyl-6-prop-2-enylsulfanylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(allylthio)-5-amino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H13N5OS MolecularWeight: 299.35092

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1N

Isomeric SMILES

C=CCSC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1N

InChI

InChI=1S/C14H13N5OS/c1-2-8-21-14-17-12-11(13(20)18(14)15)9-16-19(12)10-6-4-3-5-7-10/h2-7,9H,1,8,15H2