6-chloranyl-7-[(4-methylsulfanylphenyl)methyl]purine

Systemtic Name: 6-chloranyl-7-[(4-methylsulfanylphenyl)methyl]purine Openeye Name: 6-chloro-7-[(4-methylsulfanylphenyl)methyl]purine CAS Name: 6-chloro-7-[[4-(methylthio)phenyl]methyl]purine IUPAC Name: 6-chloro-7-[(4-methylsulfanylphenyl)methyl]purine Traditional Name: 6-chloro-7-[4-(methylthio)benzyl]purine Formula: C13H11ClN4S MolecularWeight: 290.77124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C=NC3=C2C(=NC=N3)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C=NC3=C2C(=NC=N3)Cl

InChI

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