1-phenyl-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-allylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-(prop-2-enylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-prop-2-enylsulfanylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(allylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C14H12N4S MolecularWeight: 268.33688

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=NC2=C1C=NN2C3=CC=CC=C3

Isomeric SMILES

C=CCSC1=NC=NC2=C1C=NN2C3=CC=CC=C3

InChI

InChI=1S/C14H12N4S/c1-2-8-19-14-12-9-17-18(13(12)15-10-16-14)11-6-4-3-5-7-11/h2-7,9-10H,1,8H2