6-chloranyl-9-[(4-methylsulfanylphenyl)methyl]purine

Systemtic Name: 6-chloranyl-9-[(4-methylsulfanylphenyl)methyl]purine Openeye Name: 6-chloro-9-[(4-methylsulfanylphenyl)methyl]purine CAS Name: 6-chloro-9-[[4-(methylthio)phenyl]methyl]purine IUPAC Name: 6-chloro-9-[(4-methylsulfanylphenyl)methyl]purine Traditional Name: 6-chloro-9-[4-(methylthio)benzyl]purine Formula: C13H11ClN4S MolecularWeight: 290.77124

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C13H11ClN4S/c1-19-10-4-2-9(3-5-10)6-18-8-17-11-12(14)15-7-16-13(11)18/h2-5,7-8H,6H2,1H3