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1-[(4-chlorophenyl)methyl]-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine

1-[(4-chlorophenyl)methyl]-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name:1-[(4-chlorophenyl)methyl]-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine
Openeye Name:4-allylsulfanyl-1-[(4-chlorophenyl)methyl]pyrazolo[3,4-d]pyrimidine
CAS Name:1-[(4-chlorophenyl)methyl]-4-(prop-2-enylthio)pyrazolo[3,4-d]pyrimidine
IUPAC Name:1-[(4-chlorophenyl)methyl]-4-prop-2-enylsulfanylpyrazolo[3,4-d]pyrimidine
Traditional Name:4-(allylthio)-1-(4-chlorobenzyl)pyrazolo[3,4-d]pyrimidine
Formula: C15H13ClN4S
MolecularWeight: 316.80852
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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=NC2=C1C=NN2CC3=CC=C(C=C3)Cl


Isomeric SMILES

C=CCSC1=NC=NC2=C1C=NN2CC3=CC=C(C=C3)Cl


InChI

InChI=1S/C15H13ClN4S/c1-2-7-21-15-13-8-19-20(14(13)17-10-18-15)9-11-3-5-12(16)6-4-11/h2-6,8,10H,1,7,9H2


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