8-chloranyl-6-(2,4-dimethylphenyl)-2-methylsulfanyl-7H-purine

Systemtic Name: 8-chloranyl-6-(2,4-dimethylphenyl)-2-methylsulfanyl-7H-purine Openeye Name: 8-chloro-6-(2,4-dimethylphenyl)-2-methylsulfanyl-7H-purine CAS Name: 8-chloro-6-(2,4-dimethylphenyl)-2-(methylthio)-7H-purine IUPAC Name: 8-chloro-6-(2,4-dimethylphenyl)-2-methylsulfanyl-7H-purine Traditional Name: 8-chloro-6-(2,4-dimethylphenyl)-2-(methylthio)-7H-purine Formula: C14H13ClN4S MolecularWeight: 304.79782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C3C(=NC(=N2)SC)N=C(N3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C3C(=NC(=N2)SC)N=C(N3)Cl)C

InChI

InChI=1S/C14H13ClN4S/c1-7-4-5-9(8(2)6-7)10-11-12(18-13(15)16-11)19-14(17-10)20-3/h4-6H,1-3H3,(H,16,17,18,19)